Mol:FL5FACGS0027
From Metabolomics.JP
(Difference between revisions)
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− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 43 47 0 0 0 0 0 0 0 0999 V2000 | + | 43 47 0 0 0 0 0 0 0 0999 V2000 |
− | -3.2135 0.8620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2135 0.8620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.2135 0.2197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2135 0.2197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.6572 -0.1015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6572 -0.1015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.1009 0.2197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1009 0.2197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.1009 0.8620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1009 0.8620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.6572 1.1832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6572 1.1832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.5446 -0.1015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5446 -0.1015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.9883 0.2197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9883 0.2197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.9883 0.8620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9883 0.8620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.5446 1.1832 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5446 1.1832 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.5446 -0.6023 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5446 -0.6023 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.2879 1.3069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2879 1.3069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.2791 0.9795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2791 0.9795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.8461 1.3069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8461 1.3069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.8461 1.9615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8461 1.9615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.2791 2.2889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2791 2.2889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.2879 1.9615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2879 1.9615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.6572 -0.7436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6572 -0.7436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.4529 2.3119 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4529 2.3119 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.7085 1.1832 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.7085 1.1832 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.4250 -0.1898 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4250 -0.1898 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.2791 2.9434 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2791 2.9434 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.2152 -1.4899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2152 -1.4899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.8434 -1.8526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8434 -1.8526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.6440 -1.1551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6440 -1.1551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.8434 -0.4534 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8434 -0.4534 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.2152 -0.0906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2152 -0.0906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.4144 -0.7881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4144 -0.7881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.1848 -0.7881 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1848 -0.7881 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.3765 -2.0921 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3765 -2.0921 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.6918 -2.4183 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6918 -2.4183 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.2643 -1.5132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2643 -1.5132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.7814 -2.0366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7814 -2.0366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.4806 -2.5576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4806 -2.5576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.0591 -2.3923 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0591 -2.3923 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.6411 -2.5576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6411 -2.5576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.1225 -2.0048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1225 -2.0048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.3634 -2.2018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3634 -2.2018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.2227 -2.1863 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2227 -2.1863 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.6016 -1.7893 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6016 -1.7893 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.9088 -1.2074 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9088 -1.2074 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.9940 -2.5309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9940 -2.5309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.7085 -2.9434 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7085 -2.9434 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
− | 2 3 2 0 0 0 0 | + | 2 3 2 0 0 0 0 |
− | 4 5 2 0 0 0 0 | + | 4 5 2 0 0 0 0 |
− | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
− | 6 1 2 0 0 0 0 | + | 6 1 2 0 0 0 0 |
− | 4 7 1 0 0 0 0 | + | 4 7 1 0 0 0 0 |
− | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
− | 8 9 2 0 0 0 0 | + | 8 9 2 0 0 0 0 |
− | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
− | 10 5 1 0 0 0 0 | + | 10 5 1 0 0 0 0 |
− | 7 11 2 0 0 0 0 | + | 7 11 2 0 0 0 0 |
− | 9 12 1 0 0 0 0 | + | 9 12 1 0 0 0 0 |
− | 12 13 2 0 0 0 0 | + | 12 13 2 0 0 0 0 |
− | 13 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
− | 14 15 2 0 0 0 0 | + | 14 15 2 0 0 0 0 |
− | 15 16 1 0 0 0 0 | + | 15 16 1 0 0 0 0 |
− | 16 17 2 0 0 0 0 | + | 16 17 2 0 0 0 0 |
− | 17 12 1 0 0 0 0 | + | 17 12 1 0 0 0 0 |
− | 3 18 1 0 0 0 0 | + | 3 18 1 0 0 0 0 |
− | 19 15 1 0 0 0 0 | + | 19 15 1 0 0 0 0 |
− | 20 1 1 0 0 0 0 | + | 20 1 1 0 0 0 0 |
− | 21 8 1 0 0 0 0 | + | 21 8 1 0 0 0 0 |
− | 4 3 1 0 0 0 0 | + | 4 3 1 0 0 0 0 |
− | 16 22 1 0 0 0 0 | + | 16 22 1 0 0 0 0 |
− | 24 23 1 1 0 0 0 | + | 24 23 1 1 0 0 0 |
− | 24 25 1 0 0 0 0 | + | 24 25 1 0 0 0 0 |
− | 25 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
− | 26 27 1 0 0 0 0 | + | 26 27 1 0 0 0 0 |
− | 27 28 1 1 0 0 0 | + | 27 28 1 1 0 0 0 |
− | 28 23 1 1 0 0 0 | + | 28 23 1 1 0 0 0 |
− | 28 29 1 0 0 0 0 | + | 28 29 1 0 0 0 0 |
− | 23 30 1 0 0 0 0 | + | 23 30 1 0 0 0 0 |
− | 24 31 1 0 0 0 0 | + | 24 31 1 0 0 0 0 |
− | 25 32 1 0 0 0 0 | + | 25 32 1 0 0 0 0 |
− | 27 21 1 0 0 0 0 | + | 27 21 1 0 0 0 0 |
− | 33 34 1 0 0 0 0 | + | 33 34 1 0 0 0 0 |
− | 34 35 1 1 0 0 0 | + | 34 35 1 1 0 0 0 |
− | 35 36 1 1 0 0 0 | + | 35 36 1 1 0 0 0 |
− | 37 36 1 1 0 0 0 | + | 37 36 1 1 0 0 0 |
− | 37 38 1 0 0 0 0 | + | 37 38 1 0 0 0 0 |
− | 38 33 1 0 0 0 0 | + | 38 33 1 0 0 0 0 |
− | 33 39 1 0 0 0 0 | + | 33 39 1 0 0 0 0 |
− | 38 40 1 0 0 0 0 | + | 38 40 1 0 0 0 0 |
− | 37 41 1 0 0 0 0 | + | 37 41 1 0 0 0 0 |
− | 31 34 1 0 0 0 0 | + | 31 34 1 0 0 0 0 |
− | 36 42 1 0 0 0 0 | + | 36 42 1 0 0 0 0 |
− | 42 43 1 0 0 0 0 | + | 42 43 1 0 0 0 0 |
− | M STY 1 1 SUP | + | M STY 1 1 SUP |
− | M SLB 1 1 1 | + | M SLB 1 1 1 |
− | M SAL 1 2 42 43 | + | M SAL 1 2 42 43 |
− | M SBL 1 1 46 | + | M SBL 1 1 46 |
− | M SMT 1 CH2OH | + | M SMT 1 CH2OH |
− | M SBV 1 46 -8.3427 6.2100 | + | M SBV 1 46 -8.3427 6.2100 |
− | S SKP 8 | + | S SKP 8 |
− | ID FL5FACGS0027 | + | ID FL5FACGS0027 |
− | KNApSAcK_ID C00005416 | + | KNApSAcK_ID C00005416 |
− | NAME Quercetin 3-galactosyl-(1->4)-rhamnoside | + | NAME Quercetin 3-galactosyl-(1->4)-rhamnoside |
− | CAS_RN 98618-77-0 | + | CAS_RN 98618-77-0 |
− | FORMULA C27H30O16 | + | FORMULA C27H30O16 |
− | EXACTMASS 610.153384912 | + | EXACTMASS 610.153384912 |
− | AVERAGEMASS 610.5175 | + | AVERAGEMASS 610.5175 |
− | SMILES C(=C3OC(C(O)5)OC(C)C(C5O)OC(O4)C(O)C(O)C(C4CO)O)(Oc(c2)c(C3=O)c(O)cc2O)c(c1)ccc(O)c1O | + | SMILES C(=C3OC(C(O)5)OC(C)C(C5O)OC(O4)C(O)C(O)C(C4CO)O)(Oc(c2)c(C3=O)c(O)cc2O)c(c1)ccc(O)c1O |
M END | M END | ||
− |
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/ 43 47 0 0 0 0 0 0 0 0999 V2000 -3.2135 0.8620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2135 0.2197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6572 -0.1015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1009 0.2197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1009 0.8620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6572 1.1832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5446 -0.1015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9883 0.2197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9883 0.8620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5446 1.1832 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5446 -0.6023 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2879 1.3069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2791 0.9795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8461 1.3069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8461 1.9615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2791 2.2889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2879 1.9615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6572 -0.7436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4529 2.3119 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7085 1.1832 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 -0.1898 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2791 2.9434 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2152 -1.4899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8434 -1.8526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 -1.1551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8434 -0.4534 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2152 -0.0906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4144 -0.7881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1848 -0.7881 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3765 -2.0921 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6918 -2.4183 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2643 -1.5132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7814 -2.0366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4806 -2.5576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0591 -2.3923 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6411 -2.5576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1225 -2.0048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3634 -2.2018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2227 -2.1863 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6016 -1.7893 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9088 -1.2074 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9940 -2.5309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7085 -2.9434 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 1 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 7 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 12 1 0 0 0 0 3 18 1 0 0 0 0 19 15 1 0 0 0 0 20 1 1 0 0 0 0 21 8 1 0 0 0 0 4 3 1 0 0 0 0 16 22 1 0 0 0 0 24 23 1 1 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 1 0 0 0 28 23 1 1 0 0 0 28 29 1 0 0 0 0 23 30 1 0 0 0 0 24 31 1 0 0 0 0 25 32 1 0 0 0 0 27 21 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 1 0 0 0 35 36 1 1 0 0 0 37 36 1 1 0 0 0 37 38 1 0 0 0 0 38 33 1 0 0 0 0 33 39 1 0 0 0 0 38 40 1 0 0 0 0 37 41 1 0 0 0 0 31 34 1 0 0 0 0 36 42 1 0 0 0 0 42 43 1 0 0 0 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 2 42 43 M SBL 1 1 46 M SMT 1 CH2OH M SBV 1 46 -8.3427 6.2100 S SKP 8 ID FL5FACGS0027 KNApSAcK_ID C00005416 NAME Quercetin 3-galactosyl-(1->4)-rhamnoside CAS_RN 98618-77-0 FORMULA C27H30O16 EXACTMASS 610.153384912 AVERAGEMASS 610.5175 SMILES C(=C3OC(C(O)5)OC(C)C(C5O)OC(O4)C(O)C(O)C(C4CO)O)(Oc(c2)c(C3=O)c(O)cc2O)c(c1)ccc(O)c1O M END