Mol:FL1AA9NF0002
From Metabolomics.JP
(Difference between revisions)
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− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 22 25 0 0 0 0 0 0 0 0999 V2000 | + | 22 25 0 0 0 0 0 0 0 0999 V2000 |
− | -0.9827 -0.3431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9827 -0.3431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.9827 0.2564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9827 0.2564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.5019 0.5562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5019 0.5562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.0211 0.2564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0211 0.2564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.0211 -0.3431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0211 -0.3431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.5019 -0.6429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5019 -0.6429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.4125 -0.5284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4125 -0.5284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.0601 -0.0434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0601 -0.0434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.4125 0.4417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4125 0.4417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.3817 -0.0434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3817 -0.0434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.2655 -0.0434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2655 -0.0434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.5658 -0.5635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5658 -0.5635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.1664 -0.5635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1664 -0.5635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.4667 -0.0434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4667 -0.0434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.1664 0.4767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1664 0.4767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.5658 0.4767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5658 0.4767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.2682 -1.0670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2682 -1.0670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.6266 1.1426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6266 1.1426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.2228 1.2053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2228 1.2053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.4667 0.6576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4667 0.6576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.9568 -0.7928 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9568 -0.7928 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.2423 -1.2053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2423 -1.2053 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 1 0 0 0 0 | + | 8 9 1 0 0 0 0 |
− | 9 2 1 0 0 0 0 | + | 9 2 1 0 0 0 0 |
− | 8 10 2 0 0 0 0 | + | 8 10 2 0 0 0 0 |
− | 10 11 1 0 0 0 0 | + | 10 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 |
− | 6 21 1 0 0 0 0 | + | 6 21 1 0 0 0 0 |
− | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
− | M STY 1 1 SUP | + | M STY 1 1 SUP |
− | M SLB 1 1 1 | + | M SLB 1 1 1 |
− | M SAL 1 2 21 22 | + | M SAL 1 2 21 22 |
− | M SBL 1 1 24 | + | M SBL 1 1 24 |
− | M SMT 1 OCH3 | + | M SMT 1 OCH3 |
− | M SBV 1 24 -5.7234 4.9107 | + | M SBV 1 24 -5.7234 4.9107 |
− | S SKP 8 | + | S SKP 8 |
− | ID FL1AA9NF0002 | + | ID FL1AA9NF0002 |
− | KNApSAcK_ID C00008037 | + | KNApSAcK_ID C00008037 |
− | NAME 4-Methoxyfurano[2'',3'':6,7]aurone | + | NAME 4-Methoxyfurano[2'',3'':6,7]aurone |
− | CAS_RN 61755-76-8 | + | CAS_RN 61755-76-8 |
− | FORMULA C18H12O4 | + | FORMULA C18H12O4 |
− | EXACTMASS 292.073558872 | + | EXACTMASS 292.073558872 |
− | AVERAGEMASS 292.28548 | + | AVERAGEMASS 292.28548 |
− | SMILES o(c1=Cc(c4)cccc4)c(c23)c(c(OC)cc2occ3)c1=O | + | SMILES o(c1=Cc(c4)cccc4)c(c23)c(c(OC)cc2occ3)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/ 22 25 0 0 0 0 0 0 0 0999 V2000 -0.9827 -0.3431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9827 0.2564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5019 0.5562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0211 0.2564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0211 -0.3431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5019 -0.6429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4125 -0.5284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0601 -0.0434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4125 0.4417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3817 -0.0434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2655 -0.0434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5658 -0.5635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1664 -0.5635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4667 -0.0434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1664 0.4767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5658 0.4767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2682 -1.0670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6266 1.1426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2228 1.2053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4667 0.6576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9568 -0.7928 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2423 -1.2053 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 1 0 0 0 0 9 2 1 0 0 0 0 8 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 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 6 21 1 0 0 0 0 21 22 1 0 0 0 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 2 21 22 M SBL 1 1 24 M SMT 1 OCH3 M SBV 1 24 -5.7234 4.9107 S SKP 8 ID FL1AA9NF0002 KNApSAcK_ID C00008037 NAME 4-Methoxyfurano[2'',3'':6,7]aurone CAS_RN 61755-76-8 FORMULA C18H12O4 EXACTMASS 292.073558872 AVERAGEMASS 292.28548 SMILES o(c1=Cc(c4)cccc4)c(c23)c(c(OC)cc2occ3)c1=O M END