Mol:FLIAAANI0010
From Metabolomics.JP
(Difference between revisions)
Line 1: | Line 1: | ||
− | + | ||
− | + | ||
− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 26 28 0 0 0 0 0 0 0 0999 V2000 | + | 26 28 0 0 0 0 0 0 0 0999 V2000 |
− | -1.7265 -0.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7265 -0.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.7265 -0.7693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7265 -0.7693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.1702 -1.0905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1702 -1.0905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.6139 -0.7693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6139 -0.7693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.6139 -0.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6139 -0.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.1702 0.1942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1702 0.1942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.0576 -1.0905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0576 -1.0905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.4987 -0.7693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4987 -0.7693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.4987 -0.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4987 -0.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.0576 0.1942 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0576 0.1942 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.0548 -1.0904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0548 -1.0904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.0548 -1.7772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0548 -1.7772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.6495 -2.1206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6495 -2.1206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.2443 -1.7772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2443 -1.7772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.2443 -1.0904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2443 -1.0904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.6495 -0.7470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6495 -0.7470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.0576 -1.7326 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0576 -1.7326 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.2826 0.1941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2826 0.1941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.8385 -2.1203 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8385 -2.1203 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.1702 -1.7326 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1702 -1.7326 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.1702 0.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1702 0.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.7263 1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7263 1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.7263 1.7995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7263 1.7995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.2824 2.1206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2824 2.1206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.1702 2.1206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1702 2.1206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.8385 1.7995 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8385 1.7995 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 |
− | 7 17 2 0 0 0 0 | + | 7 17 2 0 0 0 0 |
− | 1 18 1 0 0 0 0 | + | 1 18 1 0 0 0 0 |
− | 14 19 1 0 0 0 0 | + | 14 19 1 0 0 0 0 |
− | 3 20 1 0 0 0 0 | + | 3 20 1 0 0 0 0 |
− | 6 21 1 0 0 0 0 | + | 6 21 1 0 0 0 0 |
− | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
− | 22 23 2 0 0 0 0 | + | 22 23 2 0 0 0 0 |
− | 23 24 1 0 0 0 0 | + | 23 24 1 0 0 0 0 |
− | 23 25 1 0 0 0 0 | + | 23 25 1 0 0 0 0 |
− | 24 26 1 0 0 0 0 | + | 24 26 1 0 0 0 0 |
− | S SKP 8 | + | S SKP 8 |
− | ID FLIAAANI0010 | + | ID FLIAAANI0010 |
− | KNApSAcK_ID C00009902 | + | KNApSAcK_ID C00009902 |
− | NAME Gancaonin C;5,7,4'-Trihydroxy-8-(4-hydroxyprenyl)isoflavone | + | NAME Gancaonin C;5,7,4'-Trihydroxy-8-(4-hydroxyprenyl)isoflavone |
− | CAS_RN 124596-87-8 | + | CAS_RN 124596-87-8 |
− | FORMULA C20H18O6 | + | FORMULA C20H18O6 |
− | EXACTMASS 354.110338308 | + | EXACTMASS 354.110338308 |
− | AVERAGEMASS 354.35332 | + | AVERAGEMASS 354.35332 |
− | SMILES c(c3)(O)c(C1=O)c(c(CC=C(CO)C)c3O)OC=C1c(c2)ccc(O)c2 | + | SMILES c(c3)(O)c(C1=O)c(c(CC=C(CO)C)c3O)OC=C1c(c2)ccc(O)c2 |
M END | M END | ||
− |
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/ 26 28 0 0 0 0 0 0 0 0999 V2000 -1.7265 -0.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7265 -0.7693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1702 -1.0905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6139 -0.7693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6139 -0.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1702 0.1942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0576 -1.0905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4987 -0.7693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4987 -0.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0576 0.1942 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0548 -1.0904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0548 -1.7772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6495 -2.1206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2443 -1.7772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2443 -1.0904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6495 -0.7470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0576 -1.7326 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2826 0.1941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8385 -2.1203 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1702 -1.7326 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1702 0.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7263 1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7263 1.7995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2824 2.1206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1702 2.1206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8385 1.7995 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 7 17 2 0 0 0 0 1 18 1 0 0 0 0 14 19 1 0 0 0 0 3 20 1 0 0 0 0 6 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 26 1 0 0 0 0 S SKP 8 ID FLIAAANI0010 KNApSAcK_ID C00009902 NAME Gancaonin C;5,7,4'-Trihydroxy-8-(4-hydroxyprenyl)isoflavone CAS_RN 124596-87-8 FORMULA C20H18O6 EXACTMASS 354.110338308 AVERAGEMASS 354.35332 SMILES c(c3)(O)c(C1=O)c(c(CC=C(CO)C)c3O)OC=C1c(c2)ccc(O)c2 M END