Mol:FL3F18NF0002
From Metabolomics.JP
(Difference between revisions)
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− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 24 27 0 0 0 0 0 0 0 0999 V2000 | + | 24 27 0 0 0 0 0 0 0 0999 V2000 |
− | -0.7652 -1.2372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7652 -1.2372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.7652 -0.4122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7652 -0.4122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.4796 0.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4796 0.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.1941 -0.4122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1941 -0.4122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.1941 -1.2372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1941 -1.2372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.4796 -1.6497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4796 -1.6497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.0507 -1.6497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0507 -1.6497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.6638 -1.2372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6638 -1.2372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.6638 -0.4122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6638 -0.4122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.0507 0.0003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0507 0.0003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.3783 0.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3783 0.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.0927 -0.4122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0927 -0.4122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.8072 0.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8072 0.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.8072 0.8253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8072 0.8253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.0927 1.2378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0927 1.2378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.3783 0.8253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3783 0.8253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.0507 -2.4747 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0507 -2.4747 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.6512 0.8073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6512 0.8073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.4716 0.8935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4716 0.8935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.8072 0.1399 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8072 0.1399 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.0927 -1.2358 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0927 -1.2358 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.0927 2.0628 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0927 2.0628 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.8060 2.4747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8060 2.4747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.3806 -1.6469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3806 -1.6469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1 2 2 0 0 0 0 | + | 1 2 2 0 0 0 0 |
− | 2 3 1 0 0 0 0 | + | 2 3 1 0 0 0 0 |
− | 3 4 2 0 0 0 0 | + | 3 4 2 0 0 0 0 |
− | 4 5 1 0 0 0 0 | + | 4 5 1 0 0 0 0 |
− | 5 6 2 0 0 0 0 | + | 5 6 2 0 0 0 0 |
− | 6 1 1 0 0 0 0 | + | 6 1 1 0 0 0 0 |
− | 1 7 1 0 0 0 0 | + | 1 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 2 1 0 0 0 0 | + | 10 2 1 0 0 0 0 |
− | 9 11 1 0 0 0 0 | + | 9 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 2 0 0 0 0 | + | 7 17 2 0 0 0 0 |
− | 3 18 1 0 0 0 0 | + | 3 18 1 0 0 0 0 |
− | 18 19 2 0 0 0 0 | + | 18 19 2 0 0 0 0 |
− | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
− | 20 4 1 0 0 0 0 | + | 20 4 1 0 0 0 0 |
− | 12 21 1 0 0 0 0 | + | 12 21 1 0 0 0 0 |
− | 15 22 1 0 0 0 0 | + | 15 22 1 0 0 0 0 |
− | 22 23 1 0 0 0 0 | + | 22 23 1 0 0 0 0 |
− | 21 24 1 0 0 0 0 | + | 21 24 1 0 0 0 0 |
− | S SKP 8 | + | S SKP 8 |
− | ID FL3F18NF0002 | + | ID FL3F18NF0002 |
− | KNApSAcK_ID C00013453 | + | KNApSAcK_ID C00013453 |
− | NAME Millettocalyxin C;2-(2,5-Dimethoxyphenyl)-4H-furo[2,3-h]-1-benzopyran-4-one | + | NAME Millettocalyxin C;2-(2,5-Dimethoxyphenyl)-4H-furo[2,3-h]-1-benzopyran-4-one |
− | CAS_RN 422308-57-4 | + | CAS_RN 422308-57-4 |
− | FORMULA C19H14O5 | + | FORMULA C19H14O5 |
− | EXACTMASS 322.084123558 | + | EXACTMASS 322.084123558 |
− | AVERAGEMASS 322.31146 | + | AVERAGEMASS 322.31146 |
− | SMILES c(c(C(O4)=CC(c(c43)ccc(c32)occ2)=O)1)(OC)ccc(OC)c1 | + | SMILES c(c(C(O4)=CC(c(c43)ccc(c32)occ2)=O)1)(OC)ccc(OC)c1 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/ 24 27 0 0 0 0 0 0 0 0999 V2000 -0.7652 -1.2372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7652 -0.4122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4796 0.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1941 -0.4122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1941 -1.2372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4796 -1.6497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0507 -1.6497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6638 -1.2372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6638 -0.4122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0507 0.0003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3783 0.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0927 -0.4122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8072 0.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8072 0.8253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0927 1.2378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3783 0.8253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0507 -2.4747 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6512 0.8073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4716 0.8935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8072 0.1399 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0927 -1.2358 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0927 2.0628 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8060 2.4747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3806 -1.6469 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 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 1 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 2 1 0 0 0 0 9 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 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 4 1 0 0 0 0 12 21 1 0 0 0 0 15 22 1 0 0 0 0 22 23 1 0 0 0 0 21 24 1 0 0 0 0 S SKP 8 ID FL3F18NF0002 KNApSAcK_ID C00013453 NAME Millettocalyxin C;2-(2,5-Dimethoxyphenyl)-4H-furo[2,3-h]-1-benzopyran-4-one CAS_RN 422308-57-4 FORMULA C19H14O5 EXACTMASS 322.084123558 AVERAGEMASS 322.31146 SMILES c(c(C(O4)=CC(c(c43)ccc(c32)occ2)=O)1)(OC)ccc(OC)c1 M END