Mol:FLII3ANS0002
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 |
− | -2.0045 0.3479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0045 0.3479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.0045 -0.2945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0045 -0.2945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.4482 -0.6157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4482 -0.6157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.8919 -0.2945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8919 -0.2945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.8919 0.3479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8919 0.3479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.4482 0.6691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4482 0.6691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.3356 -0.6157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3356 -0.6157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.2207 -0.2945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2207 -0.2945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.7768 -0.6155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7768 -0.6155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.7768 -1.3023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7768 -1.3023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.3716 -1.6457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3716 -1.6457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.9664 -1.3023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9664 -1.3023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.9664 -0.6155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9664 -0.6155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.3716 -0.2721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3716 -0.2721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.5606 -1.6454 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5606 -1.6454 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.3339 -1.3021 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3339 -1.3021 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.5606 0.6689 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5606 0.6689 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.4482 1.3112 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4482 1.3112 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.8687 1.6457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8687 1.6457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.3358 0.6689 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3358 0.6689 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.3787 0.2564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3787 0.2564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2 3 2 0 0 0 0 | + | 2 3 2 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 1 2 0 0 0 0 | + | 6 1 2 0 0 0 0 |
− | 4 7 1 0 0 0 0 | + | 4 7 1 0 0 0 0 |
− | 7 8 2 0 0 0 0 | + | 7 8 2 0 0 0 0 |
− | 8 9 1 0 0 0 0 | + | 8 9 1 0 0 0 0 |
− | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
− | 10 11 2 0 0 0 0 | + | 10 11 2 0 0 0 0 |
− | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
− | 12 13 2 0 0 0 0 | + | 12 13 2 0 0 0 0 |
− | 13 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
− | 14 9 2 0 0 0 0 | + | 14 9 2 0 0 0 0 |
− | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
− | 12 15 1 0 0 0 0 | + | 12 15 1 0 0 0 0 |
− | 7 16 1 0 0 0 0 | + | 7 16 1 0 0 0 0 |
− | 10 16 1 0 0 0 0 | + | 10 16 1 0 0 0 0 |
− | 1 17 1 0 0 0 0 | + | 1 17 1 0 0 0 0 |
− | 6 18 1 0 0 0 0 | + | 6 18 1 0 0 0 0 |
− | 18 19 1 0 0 0 0 | + | 18 19 1 0 0 0 0 |
− | 5 20 1 0 0 0 0 | + | 5 20 1 0 0 0 0 |
− | 20 21 1 0 0 0 0 | + | 20 21 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 20 21 | + | M SAL 1 2 20 21 |
− | M SBL 1 1 22 | + | M SBL 1 1 22 |
− | M SMT 1 OCH3 | + | M SMT 1 OCH3 |
− | M SBV 1 22 -8.5186 4.9796 | + | M SBV 1 22 -8.5186 4.9796 |
− | S SKP 8 | + | S SKP 8 |
− | ID FLII3ANS0002 | + | ID FLII3ANS0002 |
− | KNApSAcK_ID C00009805 | + | KNApSAcK_ID C00009805 |
− | NAME Isopterofuran;6-Hydroxy-2-(4-hydroxy-2,3-dimethoxyphenyl)benzofuran | + | NAME Isopterofuran;6-Hydroxy-2-(4-hydroxy-2,3-dimethoxyphenyl)benzofuran |
− | CAS_RN 74048-95-6 | + | CAS_RN 74048-95-6 |
− | FORMULA C16H14O5 | + | FORMULA C16H14O5 |
− | EXACTMASS 286.084123558 | + | EXACTMASS 286.084123558 |
− | AVERAGEMASS 286.27936 | + | AVERAGEMASS 286.27936 |
− | SMILES COc(c(O)3)c(OC)c(cc3)c(c1)oc(c2)c(ccc(O)2)1 | + | SMILES COc(c(O)3)c(OC)c(cc3)c(c1)oc(c2)c(ccc(O)2)1 |
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 -2.0045 0.3479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0045 -0.2945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4482 -0.6157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8919 -0.2945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8919 0.3479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4482 0.6691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3356 -0.6157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2207 -0.2945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7768 -0.6155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7768 -1.3023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3716 -1.6457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9664 -1.3023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9664 -0.6155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3716 -0.2721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5606 -1.6454 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3339 -1.3021 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5606 0.6689 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4482 1.3112 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8687 1.6457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3358 0.6689 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3787 0.2564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 3 2 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 1 2 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 9 2 0 0 0 0 1 2 1 0 0 0 0 12 15 1 0 0 0 0 7 16 1 0 0 0 0 10 16 1 0 0 0 0 1 17 1 0 0 0 0 6 18 1 0 0 0 0 18 19 1 0 0 0 0 5 20 1 0 0 0 0 20 21 1 0 0 0 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 2 20 21 M SBL 1 1 22 M SMT 1 OCH3 M SBV 1 22 -8.5186 4.9796 S SKP 8 ID FLII3ANS0002 KNApSAcK_ID C00009805 NAME Isopterofuran;6-Hydroxy-2-(4-hydroxy-2,3-dimethoxyphenyl)benzofuran CAS_RN 74048-95-6 FORMULA C16H14O5 EXACTMASS 286.084123558 AVERAGEMASS 286.27936 SMILES COc(c(O)3)c(OC)c(cc3)c(c1)oc(c2)c(ccc(O)2)1 M END