Mol:FLIAACNI0002
From Metabolomics.JP
(Difference between revisions)
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− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 31 33 0 0 0 0 0 0 0 0999 V2000 | + | 31 33 0 0 0 0 0 0 0 0999 V2000 |
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− | 0.7756 0.2171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7756 0.2171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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− | 1.3317 -0.7463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3317 -0.7463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.3317 -1.4331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3317 -1.4331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.9265 -1.7765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9265 -1.7765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.5213 -1.4331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5213 -1.4331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.5213 -0.7463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5213 -0.7463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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− | 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 |
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− | 1 22 1 0 0 0 0 | + | 1 22 1 0 0 0 0 |
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− | 23 24 2 0 0 0 0 | + | 23 24 2 0 0 0 0 |
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− | 29 30 1 0 0 0 0 | + | 29 30 1 0 0 0 0 |
− | 29 31 1 0 0 0 0 | + | 29 31 1 0 0 0 0 |
− | S SKP 8 | + | S SKP 8 |
− | ID FLIAACNI0002 | + | ID FLIAACNI0002 |
− | KNApSAcK_ID C00009524 | + | KNApSAcK_ID C00009524 |
− | NAME 6,8-Diprenylorobol;5,7,3',4'-Tetrahydroxy-6,8-diprenylisoflavone | + | NAME 6,8-Diprenylorobol;5,7,3',4'-Tetrahydroxy-6,8-diprenylisoflavone |
− | CAS_RN 66777-70-6 | + | CAS_RN 66777-70-6 |
− | FORMULA C25H26O6 | + | FORMULA C25H26O6 |
− | EXACTMASS 422.172938564 | + | EXACTMASS 422.172938564 |
− | AVERAGEMASS 422.47033999999996 | + | AVERAGEMASS 422.47033999999996 |
− | SMILES c(c(O)1)(cc(C(C2=O)=COc(c3CC=C(C)C)c(c(c(CC=C(C)C)c3O)O)2)cc1)O | + | SMILES c(c(O)1)(cc(C(C2=O)=COc(c3CC=C(C)C)c(c(c(CC=C(C)C)c3O)O)2)cc1)O |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/ 31 33 0 0 0 0 0 0 0 0999 V2000 -1.4496 0.2171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4496 -0.4252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8933 -0.7464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 -0.4252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 0.2171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8933 0.5383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2193 -0.7464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7756 -0.4252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7756 0.2171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2193 0.5383 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3317 -0.7463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3317 -1.4331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9265 -1.7765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5213 -1.4331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5213 -0.7463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9265 -0.4029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2193 -1.3885 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8933 -1.3885 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1155 -1.7762 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0057 -0.7463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9265 -2.4626 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0057 0.5382 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0057 -1.3870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5606 -1.7074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5606 -2.3482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1155 -1.3870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8933 1.1804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3372 1.5015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3372 2.1422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2177 2.4626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8921 2.4626 0.0000 C 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 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 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 7 17 2 0 0 0 0 3 18 1 0 0 0 0 14 19 1 0 0 0 0 2 20 1 0 0 0 0 13 21 1 0 0 0 0 1 22 1 0 0 0 0 20 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 6 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 S SKP 8 ID FLIAACNI0002 KNApSAcK_ID C00009524 NAME 6,8-Diprenylorobol;5,7,3',4'-Tetrahydroxy-6,8-diprenylisoflavone CAS_RN 66777-70-6 FORMULA C25H26O6 EXACTMASS 422.172938564 AVERAGEMASS 422.47033999999996 SMILES c(c(O)1)(cc(C(C2=O)=COc(c3CC=C(C)C)c(c(c(CC=C(C)C)c3O)O)2)cc1)O M END