Mol:FL3FA9NF0001
From Metabolomics.JP
(Difference between revisions)
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− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 21 24 0 0 0 0 0 0 0 0999 V2000 | + | 21 24 0 0 0 0 0 0 0 0999 V2000 |
− | -0.7652 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7652 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.7652 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7652 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.4796 0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4796 0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.1941 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1941 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.1941 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1941 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.4796 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4796 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.0507 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0507 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.6638 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6638 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.6638 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6638 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.0507 0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0507 0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.3783 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3783 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.0927 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0927 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.8072 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8072 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.8072 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8072 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.0927 1.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0927 1.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.3783 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3783 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.0507 -1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0507 -1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.4796 -1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4796 -1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.6512 1.4257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6512 1.4257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.4716 1.5120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4716 1.5120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.8072 0.7583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8072 0.7583 0.0000 O 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 |
− | 18 6 1 0 0 0 0 | + | 18 6 1 0 0 0 0 |
− | 3 19 1 0 0 0 0 | + | 3 19 1 0 0 0 0 |
− | 19 20 2 0 0 0 0 | + | 19 20 2 0 0 0 0 |
− | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
− | 21 4 1 0 0 0 0 | + | 21 4 1 0 0 0 0 |
− | S SKP 8 | + | S SKP 8 |
− | ID FL3FA9NF0001 | + | ID FL3FA9NF0001 |
− | KNApSAcK_ID C00013443 | + | KNApSAcK_ID C00013443 |
− | NAME Pongaglabol;5-Hydroxy-2-phenyl-4H-furo[2,3-h]-1-benzopyran-4-one | + | NAME Pongaglabol;5-Hydroxy-2-phenyl-4H-furo[2,3-h]-1-benzopyran-4-one |
− | CAS_RN 75666-79-4 | + | CAS_RN 75666-79-4 |
− | FORMULA C17H10O4 | + | FORMULA C17H10O4 |
− | EXACTMASS 278.057908808 | + | EXACTMASS 278.057908808 |
− | AVERAGEMASS 278.2589 | + | AVERAGEMASS 278.2589 |
− | SMILES c(c4)ccc(c4)C(=C3)Oc(c21)c(C(=O)3)c(O)cc(occ2)1 | + | SMILES c(c4)ccc(c4)C(=C3)Oc(c21)c(C(=O)3)c(O)cc(occ2)1 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/ 21 24 0 0 0 0 0 0 0 0999 V2000 -0.7652 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7652 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4796 0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1941 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1941 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4796 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0507 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6638 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6638 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0507 0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3783 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0927 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8072 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8072 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0927 1.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3783 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0507 -1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4796 -1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6512 1.4257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4716 1.5120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8072 0.7583 0.0000 O 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 18 6 1 0 0 0 0 3 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 4 1 0 0 0 0 S SKP 8 ID FL3FA9NF0001 KNApSAcK_ID C00013443 NAME Pongaglabol;5-Hydroxy-2-phenyl-4H-furo[2,3-h]-1-benzopyran-4-one CAS_RN 75666-79-4 FORMULA C17H10O4 EXACTMASS 278.057908808 AVERAGEMASS 278.2589 SMILES c(c4)ccc(c4)C(=C3)Oc(c21)c(C(=O)3)c(O)cc(occ2)1 M END