Mol:FLIDWXNI0001
From Metabolomics.JP
(Difference between revisions)
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− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 29 32 0 0 0 0 0 0 0 0999 V2000 | + | 29 32 0 0 0 0 0 0 0 0999 V2000 |
− | -1.4496 1.8462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4496 1.8462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.4496 1.2038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4496 1.2038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.8933 0.8827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8933 0.8827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.3370 1.2038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3370 1.2038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.3370 1.8462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3370 1.8462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.8933 2.1674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8933 2.1674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.2193 0.8827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2193 0.8827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.7756 1.2038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7756 1.2038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.7756 1.8462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7756 1.8462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.2193 2.1674 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2193 2.1674 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.3317 0.8828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3317 0.8828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.3317 0.1960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3317 0.1960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.9265 -0.1474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9265 -0.1474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.5213 0.1960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5213 0.1960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.5213 0.8828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5213 0.8828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.9265 1.2262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9265 1.2262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.2210 0.1962 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2210 0.1962 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.0689 2.2037 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0689 2.2037 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.1155 -0.1471 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1155 -0.1471 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.0057 0.8828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0057 0.8828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.0057 0.2420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0057 0.2420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.5606 -0.0783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5606 -0.0783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.5606 -0.7191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5606 -0.7191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.1155 0.2420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1155 0.2420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.9265 -0.8335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9265 -0.8335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.5207 -1.1766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5207 -1.1766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.5207 -1.8614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5207 -1.8614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.9277 -2.2037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9277 -2.2037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.1137 -2.2037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1137 -2.2037 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 |
− | 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 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 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 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 |
− | 7 17 1 0 0 0 0 | + | 7 17 1 0 0 0 0 |
− | 12 17 1 0 0 0 0 | + | 12 17 1 0 0 0 0 |
− | 18 1 1 0 0 0 0 | + | 18 1 1 0 0 0 0 |
− | 14 19 1 0 0 0 0 | + | 14 19 1 0 0 0 0 |
− | 2 20 1 0 0 0 0 | + | 2 20 1 0 0 0 0 |
− | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
− | 21 22 2 0 0 0 0 | + | 21 22 2 0 0 0 0 |
− | 22 23 1 0 0 0 0 | + | 22 23 1 0 0 0 0 |
− | 22 24 1 0 0 0 0 | + | 22 24 1 0 0 0 0 |
− | 13 25 1 0 0 0 0 | + | 13 25 1 0 0 0 0 |
− | 25 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
− | 26 27 2 0 0 0 0 | + | 26 27 2 0 0 0 0 |
− | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
− | 27 29 1 0 0 0 0 | + | 27 29 1 0 0 0 0 |
− | S SKP 8 | + | S SKP 8 |
− | ID FLIDWXNI0001 | + | ID FLIDWXNI0001 |
− | KNApSAcK_ID C00010027 | + | KNApSAcK_ID C00010027 |
− | NAME Erycristagallin;3,9-Dihydroxy-2,10-diprenylpterocarpene | + | NAME Erycristagallin;3,9-Dihydroxy-2,10-diprenylpterocarpene |
− | CAS_RN 92533-56-7 | + | CAS_RN 92533-56-7 |
− | FORMULA C25H26O4 | + | FORMULA C25H26O4 |
− | EXACTMASS 390.18310931999997 | + | EXACTMASS 390.18310931999997 |
− | AVERAGEMASS 390.47153999999995 | + | AVERAGEMASS 390.47153999999995 |
− | SMILES Oc(c4)c(CC=C(C)C)c(c1c4)oc(c32)c1COc2cc(O)c(c3)CC=C(C)C | + | SMILES Oc(c4)c(CC=C(C)C)c(c1c4)oc(c32)c1COc2cc(O)c(c3)CC=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/ 29 32 0 0 0 0 0 0 0 0999 V2000 -1.4496 1.8462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4496 1.2038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8933 0.8827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 1.2038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 1.8462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8933 2.1674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2193 0.8827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7756 1.2038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7756 1.8462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2193 2.1674 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3317 0.8828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3317 0.1960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9265 -0.1474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5213 0.1960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5213 0.8828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9265 1.2262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 0.1962 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0689 2.2037 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1155 -0.1471 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0057 0.8828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0057 0.2420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5606 -0.0783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5606 -0.7191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1155 0.2420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9265 -0.8335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5207 -1.1766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5207 -1.8614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9277 -2.2037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1137 -2.2037 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 2 0 0 0 0 8 9 1 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 1 0 0 0 0 12 17 1 0 0 0 0 18 1 1 0 0 0 0 14 19 1 0 0 0 0 2 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 13 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 S SKP 8 ID FLIDWXNI0001 KNApSAcK_ID C00010027 NAME Erycristagallin;3,9-Dihydroxy-2,10-diprenylpterocarpene CAS_RN 92533-56-7 FORMULA C25H26O4 EXACTMASS 390.18310931999997 AVERAGEMASS 390.47153999999995 SMILES Oc(c4)c(CC=C(C)C)c(c1c4)oc(c32)c1COc2cc(O)c(c3)CC=C(C)C M END