Mol:FLIAALNF0002
From Metabolomics.JP
(Difference between revisions)
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− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 26 29 0 0 0 0 0 0 0 0999 V2000 | + | 26 29 0 0 0 0 0 0 0 0999 V2000 |
− | -1.3067 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3067 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.3067 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3067 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.7504 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7504 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.1941 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1941 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.1941 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1941 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.7504 1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7504 1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.3622 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3622 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.9185 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9185 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.9185 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9185 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.3622 1.1574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3622 1.1574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.4746 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4746 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.4746 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4746 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.0694 -1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0694 -1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.6642 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6642 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.6642 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6642 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.0694 0.2162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0694 0.2162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.9176 1.0347 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9176 1.0347 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.2952 0.5150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2952 0.5150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.9176 -0.0046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9176 -0.0046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.7504 -0.7694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7504 -0.7694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.3622 -0.7694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3622 -0.7694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.2584 -1.1571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2584 -1.1571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.9373 0.5150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.9373 0.5150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.2584 1.0711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2584 1.0711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.2584 -0.0411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2584 -0.0411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.0694 0.9023 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0694 0.9023 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2 3 2 0 0 0 0 | + | 2 3 2 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 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 |
− | 8 11 1 0 0 0 0 | + | 8 11 1 0 0 0 0 |
− | 11 12 1 0 0 0 0 | + | 11 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 11 2 0 0 0 0 | + | 16 11 2 0 0 0 0 |
− | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
− | 1 17 1 0 0 0 0 | + | 1 17 1 0 0 0 0 |
− | 17 18 1 0 0 0 0 | + | 17 18 1 0 0 0 0 |
− | 18 19 1 0 0 0 0 | + | 18 19 1 0 0 0 0 |
− | 19 2 1 0 0 0 0 | + | 19 2 1 0 0 0 0 |
− | 3 20 1 0 0 0 0 | + | 3 20 1 0 0 0 0 |
− | 7 21 2 0 0 0 0 | + | 7 21 2 0 0 0 0 |
− | 14 22 1 0 0 0 0 | + | 14 22 1 0 0 0 0 |
− | 18 23 1 0 0 0 0 | + | 18 23 1 0 0 0 0 |
− | 23 24 2 0 0 0 0 | + | 23 24 2 0 0 0 0 |
− | 23 25 1 0 0 0 0 | + | 23 25 1 0 0 0 0 |
− | 16 26 1 0 0 0 0 | + | 16 26 1 0 0 0 0 |
− | S SKP 8 | + | S SKP 8 |
− | ID FLIAALNF0002 | + | ID FLIAALNF0002 |
− | KNApSAcK_ID C00009837 | + | KNApSAcK_ID C00009837 |
− | NAME Lupinisoflavone A | + | NAME Lupinisoflavone A |
− | CAS_RN 93373-45-6 | + | CAS_RN 93373-45-6 |
− | FORMULA C20H16O6 | + | FORMULA C20H16O6 |
− | EXACTMASS 352.094688244 | + | EXACTMASS 352.094688244 |
− | AVERAGEMASS 352.33744 | + | AVERAGEMASS 352.33744 |
− | SMILES c(C3=O)(c(OC=C(c(c4)c(O)cc(O)c4)3)2)c(O)c(c1c2)CC(O1)C(C)=C | + | SMILES c(C3=O)(c(OC=C(c(c4)c(O)cc(O)c4)3)2)c(O)c(c1c2)CC(O1)C(C)=C |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/ 26 29 0 0 0 0 0 0 0 0999 V2000 -1.3067 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3067 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7504 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1941 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1941 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7504 1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3622 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9185 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9185 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3622 1.1574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4746 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4746 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0694 -1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6642 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6642 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0694 0.2162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9176 1.0347 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2952 0.5150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9176 -0.0046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7504 -0.7694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3622 -0.7694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2584 -1.1571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9373 0.5150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2584 1.0711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2584 -0.0411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0694 0.9023 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 3 2 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 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 8 11 1 0 0 0 0 11 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 11 2 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 2 1 0 0 0 0 3 20 1 0 0 0 0 7 21 2 0 0 0 0 14 22 1 0 0 0 0 18 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 16 26 1 0 0 0 0 S SKP 8 ID FLIAALNF0002 KNApSAcK_ID C00009837 NAME Lupinisoflavone A CAS_RN 93373-45-6 FORMULA C20H16O6 EXACTMASS 352.094688244 AVERAGEMASS 352.33744 SMILES c(C3=O)(c(OC=C(c(c4)c(O)cc(O)c4)3)2)c(O)c(c1c2)CC(O1)C(C)=C M END