Mol:FL7AAIGL0033
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 89 97 0 0 0 0 0 0 0 0999 V2000 | + | 89 97 0 0 0 0 0 0 0 0999 V2000 |
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| − | 1.7026 6.8605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7026 6.8605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | 4.8889 1.9179 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.8889 1.9179 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | 3.3029 -0.4272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3029 -0.4272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.1372 0.1139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.1372 0.1139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.1308 0.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.1308 0.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.3543 1.1232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.3543 1.1232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5199 0.5822 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5199 0.5822 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | 2.8715 0.2068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8715 0.2068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5602 -0.3461 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5602 -0.3461 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9891 0.4635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9891 0.4635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4386 1.2420 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4386 1.2420 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | -4.9724 -7.8052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.9724 -7.8052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.1474 -7.8052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.1474 -7.8052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | -5.3624 -8.5066 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.3624 -8.5066 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.3952 6.1116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.3952 6.1116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1 2 2 0 0 0 0 | + | 1 2 2 0 0 0 0 |
| − | 2 3 1 0 0 0 0 | + | 2 3 1 0 0 0 0 |
| − | 3 4 2 0 0 0 0 | + | 3 4 2 0 0 0 0 |
| − | 4 5 1 0 0 0 0 | + | 4 5 1 0 0 0 0 |
| − | 5 6 2 0 0 0 0 | + | 5 6 2 0 0 0 0 |
| − | 6 1 1 0 0 0 0 | + | 6 1 1 0 0 0 0 |
| − | 2 7 1 0 0 0 0 | + | 2 7 1 0 0 0 0 |
| − | 7 8 2 0 0 0 0 | + | 7 8 2 0 0 0 0 |
| − | 8 9 1 0 0 0 0 | + | 8 9 1 0 0 0 0 |
| − | 9 10 2 0 0 0 0 | + | 9 10 2 0 0 0 0 |
| − | 10 3 1 0 0 0 0 | + | 10 3 1 0 0 0 0 |
| − | 9 11 1 0 0 0 0 | + | 9 11 1 0 0 0 0 |
| − | 11 12 2 0 0 0 0 | + | 11 12 2 0 0 0 0 |
| − | 12 13 1 0 0 0 0 | + | 12 13 1 0 0 0 0 |
| − | 13 14 2 0 0 0 0 | + | 13 14 2 0 0 0 0 |
| − | 14 15 1 0 0 0 0 | + | 14 15 1 0 0 0 0 |
| − | 15 16 2 0 0 0 0 | + | 15 16 2 0 0 0 0 |
| − | 16 11 1 0 0 0 0 | + | 16 11 1 0 0 0 0 |
| − | 14 17 1 0 0 0 0 | + | 14 17 1 0 0 0 0 |
| − | 5 18 1 0 0 0 0 | + | 5 18 1 0 0 0 0 |
| − | 1 19 1 0 0 0 0 | + | 1 19 1 0 0 0 0 |
| − | 8 20 1 0 0 0 0 | + | 8 20 1 0 0 0 0 |
| − | 15 21 1 0 0 0 0 | + | 15 21 1 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
| − | 13 23 1 0 0 0 0 | + | 13 23 1 0 0 0 0 |
| − | 24 25 1 0 0 0 0 | + | 24 25 1 0 0 0 0 |
| − | 25 26 1 1 0 0 0 | + | 25 26 1 1 0 0 0 |
| − | 27 26 1 1 0 0 0 | + | 27 26 1 1 0 0 0 |
| − | 28 27 1 1 0 0 0 | + | 28 27 1 1 0 0 0 |
| − | 28 29 1 0 0 0 0 | + | 28 29 1 0 0 0 0 |
| − | 29 24 1 0 0 0 0 | + | 29 24 1 0 0 0 0 |
| − | 29 30 1 0 0 0 0 | + | 29 30 1 0 0 0 0 |
| − | 30 31 1 0 0 0 0 | + | 30 31 1 0 0 0 0 |
| − | 24 32 1 0 0 0 0 | + | 24 32 1 0 0 0 0 |
| − | 25 33 1 0 0 0 0 | + | 25 33 1 0 0 0 0 |
| − | 26 34 1 0 0 0 0 | + | 26 34 1 0 0 0 0 |
| − | 19 27 1 0 0 0 0 | + | 19 27 1 0 0 0 0 |
| − | 35 36 1 0 0 0 0 | + | 35 36 1 0 0 0 0 |
| − | 36 37 1 1 0 0 0 | + | 36 37 1 1 0 0 0 |
| − | 38 37 1 1 0 0 0 | + | 38 37 1 1 0 0 0 |
| − | 39 38 1 1 0 0 0 | + | 39 38 1 1 0 0 0 |
| − | 39 40 1 0 0 0 0 | + | 39 40 1 0 0 0 0 |
| − | 40 35 1 0 0 0 0 | + | 40 35 1 0 0 0 0 |
| − | 20 36 1 0 0 0 0 | + | 20 36 1 0 0 0 0 |
| − | 35 41 1 0 0 0 0 | + | 35 41 1 0 0 0 0 |
| − | 40 42 1 0 0 0 0 | + | 40 42 1 0 0 0 0 |
| − | 39 43 1 0 0 0 0 | + | 39 43 1 0 0 0 0 |
| − | 38 44 1 0 0 0 0 | + | 38 44 1 0 0 0 0 |
| − | 44 45 1 0 0 0 0 | + | 44 45 1 0 0 0 0 |
| − | 46 47 1 0 0 0 0 | + | 46 47 1 0 0 0 0 |
| − | 47 48 1 1 0 0 0 | + | 47 48 1 1 0 0 0 |
| − | 49 48 1 1 0 0 0 | + | 49 48 1 1 0 0 0 |
| − | 50 49 1 1 0 0 0 | + | 50 49 1 1 0 0 0 |
| − | 50 51 1 0 0 0 0 | + | 50 51 1 0 0 0 0 |
| − | 51 46 1 0 0 0 0 | + | 51 46 1 0 0 0 0 |
| − | 45 50 1 0 0 0 0 | + | 45 50 1 0 0 0 0 |
| − | 49 52 1 0 0 0 0 | + | 49 52 1 0 0 0 0 |
| − | 48 53 1 0 0 0 0 | + | 48 53 1 0 0 0 0 |
| − | 46 54 1 0 0 0 0 | + | 46 54 1 0 0 0 0 |
| − | 47 55 1 0 0 0 0 | + | 47 55 1 0 0 0 0 |
| − | 55 56 1 0 0 0 0 | + | 55 56 1 0 0 0 0 |
| − | 56 57 2 0 0 0 0 | + | 56 57 2 0 0 0 0 |
| − | 56 58 1 0 0 0 0 | + | 56 58 1 0 0 0 0 |
| − | 58 59 2 0 0 0 0 | + | 58 59 2 0 0 0 0 |
| − | 59 60 1 0 0 0 0 | + | 59 60 1 0 0 0 0 |
| − | 60 61 2 0 0 0 0 | + | 60 61 2 0 0 0 0 |
| − | 61 62 1 0 0 0 0 | + | 61 62 1 0 0 0 0 |
| − | 62 63 2 0 0 0 0 | + | 62 63 2 0 0 0 0 |
| − | 63 64 1 0 0 0 0 | + | 63 64 1 0 0 0 0 |
| − | 64 65 2 0 0 0 0 | + | 64 65 2 0 0 0 0 |
| − | 65 60 1 0 0 0 0 | + | 65 60 1 0 0 0 0 |
| − | 63 66 1 0 0 0 0 | + | 63 66 1 0 0 0 0 |
| − | 67 68 1 1 0 0 0 | + | 67 68 1 1 0 0 0 |
| − | 68 69 1 1 0 0 0 | + | 68 69 1 1 0 0 0 |
| − | 70 69 1 1 0 0 0 | + | 70 69 1 1 0 0 0 |
| − | 70 71 1 0 0 0 0 | + | 70 71 1 0 0 0 0 |
| − | 71 72 1 0 0 0 0 | + | 71 72 1 0 0 0 0 |
| − | 72 67 1 0 0 0 0 | + | 72 67 1 0 0 0 0 |
| − | 69 73 1 0 0 0 0 | + | 69 73 1 0 0 0 0 |
| − | 67 74 1 0 0 0 0 | + | 67 74 1 0 0 0 0 |
| − | 68 75 1 0 0 0 0 | + | 68 75 1 0 0 0 0 |
| − | 66 70 1 0 0 0 0 | + | 66 70 1 0 0 0 0 |
| − | 72 76 1 0 0 0 0 | + | 72 76 1 0 0 0 0 |
| − | 76 77 1 0 0 0 0 | + | 76 77 1 0 0 0 0 |
| − | 77 78 1 0 0 0 0 | + | 77 78 1 0 0 0 0 |
| − | 78 79 2 0 0 0 0 | + | 78 79 2 0 0 0 0 |
| − | 78 80 1 0 0 0 0 | + | 78 80 1 0 0 0 0 |
| − | 80 81 2 0 0 0 0 | + | 80 81 2 0 0 0 0 |
| − | 81 82 1 0 0 0 0 | + | 81 82 1 0 0 0 0 |
| − | 82 83 2 0 0 0 0 | + | 82 83 2 0 0 0 0 |
| − | 83 84 1 0 0 0 0 | + | 83 84 1 0 0 0 0 |
| − | 84 85 2 0 0 0 0 | + | 84 85 2 0 0 0 0 |
| − | 85 86 1 0 0 0 0 | + | 85 86 1 0 0 0 0 |
| − | 86 87 2 0 0 0 0 | + | 86 87 2 0 0 0 0 |
| − | 87 82 1 0 0 0 0 | + | 87 82 1 0 0 0 0 |
| − | 85 88 1 0 0 0 0 | + | 85 88 1 0 0 0 0 |
| − | 23 89 1 0 0 0 0 | + | 23 89 1 0 0 0 0 |
| − | M CHG 1 10 1 | + | M CHG 1 10 1 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID FL7AAIGL0033 | + | ID FL7AAIGL0033 |
| − | FORMULA C59H67O30 | + | FORMULA C59H67O30 |
| − | EXACTMASS 1255.371715804 | + | EXACTMASS 1255.371715804 |
| − | AVERAGEMASS 1256.14528 | + | AVERAGEMASS 1256.14528 |
| − | SMILES c(c9)(ccc(c9)O)C=CC(OCC(C8O)OC(C(C8O)O)Oc(c1)ccc(C=CC(OC(C(O)2)C(OC(OCC(C(O)3)OC(Oc(c6)c(c(c7)cc(OC)c(O)c7OC)[o+1]c(c64)cc(cc4OC(C5O)OC(C(C5O)O)CO)O)C(O)C3O)C2O)C)=O)c1)=O | + | SMILES c(c9)(ccc(c9)O)C=CC(OCC(C8O)OC(C(C8O)O)Oc(c1)ccc(C=CC(OC(C(O)2)C(OC(OCC(C(O)3)OC(Oc(c6)c(c(c7)cc(OC)c(O)c7OC)[o+1]c(c64)cc(cc4OC(C5O)OC(C(C5O)O)CO)O)C(O)C3O)C2O)C)=O)c1)=O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
89 97 0 0 0 0 0 0 0 0999 V2000
-1.2369 4.3722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5125 4.7904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5125 5.6269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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M CHG 1 10 1
S SKP 5
ID FL7AAIGL0033
FORMULA C59H67O30
EXACTMASS 1255.371715804
AVERAGEMASS 1256.14528
SMILES c(c9)(ccc(c9)O)C=CC(OCC(C8O)OC(C(C8O)O)Oc(c1)ccc(C=CC(OC(C(O)2)C(OC(OCC(C(O)3)OC(Oc(c6)c(c(c7)cc(OC)c(O)c7OC)[o+1]c(c64)cc(cc4OC(C5O)OC(C(C5O)O)CO)O)C(O)C3O)C2O)C)=O)c1)=O
M END
