Mol:FL3FALNP0016
From Metabolomics.JP
(Difference between revisions)
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− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 37 40 0 0 0 0 0 0 0 0999 V2000 | + | 37 40 0 0 0 0 0 0 0 0999 V2000 |
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− | -1.0717 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0717 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.7862 2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7862 2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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− | -3.3131 1.5067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3131 1.5067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.7862 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7862 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.7862 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7862 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.5007 -2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5007 -2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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− | 3 19 1 0 0 0 0 | + | 3 19 1 0 0 0 0 |
− | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
− | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
− | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
− | 22 17 1 0 0 0 0 | + | 22 17 1 0 0 0 0 |
− | 12 23 1 0 0 0 0 | + | 12 23 1 0 0 0 0 |
− | 10 24 1 0 0 0 0 | + | 10 24 1 0 0 0 0 |
− | 21 25 1 0 0 0 0 | + | 21 25 1 0 0 0 0 |
− | 21 26 1 0 0 0 0 | + | 21 26 1 0 0 0 0 |
− | 6 27 1 0 0 0 0 | + | 6 27 1 0 0 0 0 |
− | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
− | 28 29 2 0 0 0 0 | + | 28 29 2 0 0 0 0 |
− | 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 |
− | 20 32 1 0 0 0 0 | + | 20 32 1 0 0 0 0 |
− | 16 33 1 0 0 0 0 | + | 16 33 1 0 0 0 0 |
− | 33 34 1 0 0 0 0 | + | 33 34 1 0 0 0 0 |
− | 34 35 2 0 0 0 0 | + | 34 35 2 0 0 0 0 |
− | 35 36 1 0 0 0 0 | + | 35 36 1 0 0 0 0 |
− | 35 37 1 0 0 0 0 | + | 35 37 1 0 0 0 0 |
− | S SKP 8 | + | S SKP 8 |
− | ID FL3FALNP0016 | + | ID FL3FALNP0016 |
− | KNApSAcK_ID C00013458 | + | KNApSAcK_ID C00013458 |
− | NAME Dorsilurin B;(-)-2-(2,4-Dihydroxyphenyl)-9,10-dihydro-5,9-dihydroxy-8,8-dimethyl-3,6-bis(3-methyl-2-butenyl)-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one | + | NAME Dorsilurin B;(-)-2-(2,4-Dihydroxyphenyl)-9,10-dihydro-5,9-dihydroxy-8,8-dimethyl-3,6-bis(3-methyl-2-butenyl)-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one |
− | CAS_RN 212071-81-3 | + | CAS_RN 212071-81-3 |
− | FORMULA C30H34O7 | + | FORMULA C30H34O7 |
− | EXACTMASS 506.230453442 | + | EXACTMASS 506.230453442 |
− | AVERAGEMASS 506.58676 | + | AVERAGEMASS 506.58676 |
− | SMILES c(c41)(c(c(O)c(c24)C(C(CC=C(C)C)=C(c(c3O)ccc(c3)O)O2)=O)CC=C(C)C)OC(C)(C)C(C1)O | + | SMILES c(c41)(c(c(O)c(c24)C(C(CC=C(C)C)=C(c(c3O)ccc(c3)O)O2)=O)CC=C(C)C)OC(C)(C)C(C1)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/ 37 40 0 0 0 0 0 0 0 0999 V2000 -0.3572 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3572 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0717 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0717 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3572 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0717 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0717 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3572 0.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7862 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5006 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2151 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2151 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5006 2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7862 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3572 -1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7862 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7862 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0717 -1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0717 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7862 2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5006 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5006 0.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9296 2.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5006 -0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7828 2.4252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3131 1.5067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7862 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7862 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5007 -2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5007 -2.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2151 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7862 2.8875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5006 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5006 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2151 -2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9296 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2151 -2.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 17 2 0 0 0 0 16 4 2 0 0 0 0 4 1 1 0 0 0 0 1 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 2 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 10 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 9 1 0 0 0 0 5 15 2 0 0 0 0 17 16 1 0 0 0 0 4 18 1 0 0 0 0 3 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 17 1 0 0 0 0 12 23 1 0 0 0 0 10 24 1 0 0 0 0 21 25 1 0 0 0 0 21 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 20 32 1 0 0 0 0 16 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 2 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 S SKP 8 ID FL3FALNP0016 KNApSAcK_ID C00013458 NAME Dorsilurin B;(-)-2-(2,4-Dihydroxyphenyl)-9,10-dihydro-5,9-dihydroxy-8,8-dimethyl-3,6-bis(3-methyl-2-butenyl)-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one CAS_RN 212071-81-3 FORMULA C30H34O7 EXACTMASS 506.230453442 AVERAGEMASS 506.58676 SMILES c(c41)(c(c(O)c(c24)C(C(CC=C(C)C)=C(c(c3O)ccc(c3)O)O2)=O)CC=C(C)C)OC(C)(C)C(C1)O M END