Mol:FL3FA8NS0013
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 23 0 0 0 0 0 0 0 0999 V2000 | + | 21 23 0 0 0 0 0 0 0 0999 V2000 |
− | -1.0201 -0.6112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0201 -0.6112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.0297 0.2138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0297 0.2138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.3557 -1.0161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3557 -1.0161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.3879 -0.6311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3879 -0.6311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.4089 0.2141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4089 0.2141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.3201 0.6346 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3201 0.6346 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.1234 0.6266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1234 0.6266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.7003 0.6186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7003 0.6186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.4418 0.2267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4418 0.2267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.4458 -0.6332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4458 -0.6332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.7386 -1.0325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7386 -1.0325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.3557 -1.8407 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3557 -1.8407 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.8371 0.1998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8371 0.1998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.5548 0.6177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5548 0.6177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.5572 1.4431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5572 1.4431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.8416 1.8575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8416 1.8575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.1272 1.4450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1272 1.4450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.7386 -1.8575 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7386 -1.8575 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.1563 0.6392 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1563 0.6392 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.1563 0.2704 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1563 0.2704 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.8371 -0.4465 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8371 -0.4465 0.0000 O 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 |
− | 1 3 1 0 0 0 0 | + | 1 3 1 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 2 1 0 0 0 0 | + | 6 2 1 0 0 0 0 |
− | 7 5 1 0 0 0 0 | + | 7 5 1 0 0 0 0 |
− | 2 8 2 0 0 0 0 | + | 2 8 2 0 0 0 0 |
− | 8 9 1 0 0 0 0 | + | 8 9 1 0 0 0 0 |
− | 9 10 2 0 0 0 0 | + | 9 10 2 0 0 0 0 |
− | 10 11 1 0 0 0 0 | + | 10 11 1 0 0 0 0 |
− | 11 1 2 0 0 0 0 | + | 11 1 2 0 0 0 0 |
− | 3 12 2 0 0 0 0 | + | 3 12 2 0 0 0 0 |
− | 7 13 2 0 0 0 0 | + | 7 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 17 2 0 0 0 0 | + | 16 17 2 0 0 0 0 |
− | 17 7 1 0 0 0 0 | + | 17 7 1 0 0 0 0 |
− | 11 18 1 0 0 0 0 | + | 11 18 1 0 0 0 0 |
− | 9 19 1 0 0 0 0 | + | 9 19 1 0 0 0 0 |
− | 14 20 1 0 0 0 0 | + | 14 20 1 0 0 0 0 |
− | 13 21 1 0 0 0 0 | + | 13 21 1 0 0 0 0 |
− | S SKP 8 | + | S SKP 8 |
− | ID FL3FA8NS0013 | + | ID FL3FA8NS0013 |
− | KNApSAcK_ID C00013561 | + | KNApSAcK_ID C00013561 |
− | NAME 5,7,2',3'-Tetrahydroxyflavone;2-(2,3-Dihydroxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one | + | NAME 5,7,2',3'-Tetrahydroxyflavone;2-(2,3-Dihydroxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one |
− | CAS_RN 74805-70-2 | + | CAS_RN 74805-70-2 |
− | FORMULA C15H10O6 | + | FORMULA C15H10O6 |
− | EXACTMASS 286.047738052 | + | EXACTMASS 286.047738052 |
− | AVERAGEMASS 286.2363 | + | AVERAGEMASS 286.2363 |
− | SMILES Oc(c3)cc(O1)c(c(O)3)C(=O)C=C1c(c2)c(O)c(O)cc2 | + | SMILES Oc(c3)cc(O1)c(c(O)3)C(=O)C=C1c(c2)c(O)c(O)cc2 |
M END | M END | ||
− |
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/ 21 23 0 0 0 0 0 0 0 0999 V2000 -1.0201 -0.6112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0297 0.2138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3557 -1.0161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3879 -0.6311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4089 0.2141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3201 0.6346 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1234 0.6266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7003 0.6186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4418 0.2267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4458 -0.6332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7386 -1.0325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3557 -1.8407 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8371 0.1998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5548 0.6177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5572 1.4431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8416 1.8575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1272 1.4450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7386 -1.8575 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1563 0.6392 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1563 0.2704 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8371 -0.4465 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 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 2 1 0 0 0 0 7 5 1 0 0 0 0 2 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 1 2 0 0 0 0 3 12 2 0 0 0 0 7 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 17 2 0 0 0 0 17 7 1 0 0 0 0 11 18 1 0 0 0 0 9 19 1 0 0 0 0 14 20 1 0 0 0 0 13 21 1 0 0 0 0 S SKP 8 ID FL3FA8NS0013 KNApSAcK_ID C00013561 NAME 5,7,2',3'-Tetrahydroxyflavone;2-(2,3-Dihydroxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one CAS_RN 74805-70-2 FORMULA C15H10O6 EXACTMASS 286.047738052 AVERAGEMASS 286.2363 SMILES Oc(c3)cc(O1)c(c(O)3)C(=O)C=C1c(c2)c(O)c(O)cc2 M END