Mol:FL5FBANI0001
From Metabolomics.JP
(Difference between revisions)
Line 1: | Line 1: | ||
− | + | ||
− | + | ||
− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 27 29 0 0 0 0 0 0 0 0999 V2000 | + | 27 29 0 0 0 0 0 0 0 0999 V2000 |
− | -1.0423 -1.0216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0423 -1.0216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.0520 -0.1967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0520 -0.1967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.3305 -1.4259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3305 -1.4259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.3840 -1.0093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3840 -1.0093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.3784 -0.1824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3784 -0.1824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.3425 0.2242 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3425 0.2242 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.8093 -0.1841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8093 -0.1841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.0928 0.2301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0928 0.2301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.7637 0.2075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7637 0.2075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.4785 -0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4785 -0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.4714 -1.0381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4714 -1.0381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.7589 -1.4427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7589 -1.4427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.5152 0.2573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5152 0.2573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.4962 1.0976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4962 1.0976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.7783 1.4992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7783 1.4992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.0767 1.0654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0767 1.0654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.7589 -2.2677 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7589 -2.2677 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.3305 -2.2508 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3305 -2.2508 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.0985 -1.4218 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0985 -1.4218 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.1930 0.2033 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1930 0.2033 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.7637 1.0325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7637 1.0325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.4795 1.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4795 1.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.2106 1.5101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2106 1.5101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.4795 2.2574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4795 2.2574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.2106 2.6795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2106 2.6795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.7812 2.6605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7812 2.6605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.0456 -2.6795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0456 -2.6795 0.0000 C 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 |
− | 1 3 1 0 0 0 0 | + | 1 3 1 0 0 0 0 |
− | 3 4 1 0 0 0 0 | + | 3 4 1 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 2 1 0 0 0 0 | + | 6 2 1 0 0 0 0 |
− | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
− | 8 5 1 0 0 0 0 | + | 8 5 1 0 0 0 0 |
− | 2 9 2 0 0 0 0 | + | 2 9 2 0 0 0 0 |
− | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
− | 10 11 2 0 0 0 0 | + | 10 11 2 0 0 0 0 |
− | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
− | 12 1 2 0 0 0 0 | + | 12 1 2 0 0 0 0 |
− | 7 13 2 0 0 0 0 | + | 7 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 8 2 0 0 0 0 | + | 16 8 2 0 0 0 0 |
− | 12 17 1 0 0 0 0 | + | 12 17 1 0 0 0 0 |
− | 3 18 2 0 0 0 0 | + | 3 18 2 0 0 0 0 |
− | 4 19 1 0 0 0 0 | + | 4 19 1 0 0 0 0 |
− | 10 20 1 0 0 0 0 | + | 10 20 1 0 0 0 0 |
− | 9 21 1 0 0 0 0 | + | 9 21 1 0 0 0 0 |
− | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
− | 23 14 1 0 0 0 0 | + | 23 14 1 0 0 0 0 |
− | 22 24 2 0 0 0 0 | + | 22 24 2 0 0 0 0 |
− | 24 25 1 0 0 0 0 | + | 24 25 1 0 0 0 0 |
− | 24 26 1 0 0 0 0 | + | 24 26 1 0 0 0 0 |
− | 17 27 1 0 0 0 0 | + | 17 27 1 0 0 0 0 |
− | S SKP 8 | + | S SKP 8 |
− | ID FL5FBANI0001 | + | ID FL5FBANI0001 |
− | KNApSAcK_ID C00013518 | + | KNApSAcK_ID C00013518 |
− | NAME Sophoflavescenol;3,7-Dihydroxy-2-(4-hydroxyphenyl)-5-methoxy-8-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one | + | NAME Sophoflavescenol;3,7-Dihydroxy-2-(4-hydroxyphenyl)-5-methoxy-8-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one |
− | CAS_RN 216450-65-6 | + | CAS_RN 216450-65-6 |
− | FORMULA C21H20O6 | + | FORMULA C21H20O6 |
− | EXACTMASS 368.125988372 | + | EXACTMASS 368.125988372 |
− | AVERAGEMASS 368.37989999999996 | + | AVERAGEMASS 368.37989999999996 |
− | SMILES c(c3)c(ccc(O)3)C(O2)=C(C(c(c21)c(cc(O)c(CC=C(C)C)1)OC)=O)O | + | SMILES c(c3)c(ccc(O)3)C(O2)=C(C(c(c21)c(cc(O)c(CC=C(C)C)1)OC)=O)O |
M END | M END | ||
− |
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/ 27 29 0 0 0 0 0 0 0 0999 V2000 -1.0423 -1.0216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 -0.1967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3305 -1.4259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3840 -1.0093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3784 -0.1824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3425 0.2242 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8093 -0.1841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0928 0.2301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7637 0.2075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4785 -0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4714 -1.0381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7589 -1.4427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5152 0.2573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4962 1.0976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7783 1.4992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0767 1.0654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7589 -2.2677 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3305 -2.2508 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0985 -1.4218 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1930 0.2033 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7637 1.0325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4795 1.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2106 1.5101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4795 2.2574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2106 2.6795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7812 2.6605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0456 -2.6795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 2 1 0 0 0 0 7 8 1 0 0 0 0 8 5 1 0 0 0 0 2 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 1 2 0 0 0 0 7 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 8 2 0 0 0 0 12 17 1 0 0 0 0 3 18 2 0 0 0 0 4 19 1 0 0 0 0 10 20 1 0 0 0 0 9 21 1 0 0 0 0 21 22 1 0 0 0 0 23 14 1 0 0 0 0 22 24 2 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 17 27 1 0 0 0 0 S SKP 8 ID FL5FBANI0001 KNApSAcK_ID C00013518 NAME Sophoflavescenol;3,7-Dihydroxy-2-(4-hydroxyphenyl)-5-methoxy-8-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one CAS_RN 216450-65-6 FORMULA C21H20O6 EXACTMASS 368.125988372 AVERAGEMASS 368.37989999999996 SMILES c(c3)c(ccc(O)3)C(O2)=C(C(c(c21)c(cc(O)c(CC=C(C)C)1)OC)=O)O M END