Mol:FL1C9ANS0002
From Metabolomics.JP
(Difference between revisions)
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− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 20 21 0 0 0 0 0 0 0 0999 V2000 | + | 20 21 0 0 0 0 0 0 0 0999 V2000 |
− | -2.8674 0.3212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8674 0.3212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.8674 -0.3212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8674 -0.3212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.3111 -0.6424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3111 -0.6424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.7548 -0.3212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7548 -0.3212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.7548 0.3212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7548 0.3212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.3111 0.6424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3111 0.6424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.1985 -0.6424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1985 -0.6424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.6422 -0.3212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6422 -0.3212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.0861 -0.6422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0861 -0.6422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.4700 -0.3212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4700 -0.3212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.0310 -0.6451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0310 -0.6451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.5920 -0.3212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5920 -0.3212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.5920 0.3266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5920 0.3266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.0310 0.6505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0310 0.6505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.4700 0.3266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4700 0.3266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.1985 -1.1437 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1985 -1.1437 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.3111 -1.2845 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3111 -1.2845 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.3111 1.2845 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3111 1.2845 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.1529 0.6504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1529 0.6504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.8674 0.2379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8674 0.2379 0.0000 C 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 |
− | 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 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 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 15 2 0 0 0 0 | + | 14 15 2 0 0 0 0 |
− | 15 10 1 0 0 0 0 | + | 15 10 1 0 0 0 0 |
− | 7 16 2 0 0 0 0 | + | 7 16 2 0 0 0 0 |
− | 3 17 1 0 0 0 0 | + | 3 17 1 0 0 0 0 |
− | 6 18 1 0 0 0 0 | + | 6 18 1 0 0 0 0 |
− | 13 19 1 0 0 0 0 | + | 13 19 1 0 0 0 0 |
− | 19 20 1 0 0 0 0 | + | 19 20 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 19 20 | + | M SAL 1 2 19 20 |
− | M SBL 1 1 20 | + | M SBL 1 1 20 |
− | M SMT 1 OCH3 | + | M SMT 1 OCH3 |
− | M SBV 1 20 -5.0455 2.6250 | + | M SBV 1 20 -5.0455 2.6250 |
− | S SKP 8 | + | S SKP 8 |
− | ID FL1C9ANS0002 | + | ID FL1C9ANS0002 |
− | KNApSAcK_ID C00006930 | + | KNApSAcK_ID C00006930 |
− | NAME 2',5'-Dihydroxy-4-methoxychalcone | + | NAME 2',5'-Dihydroxy-4-methoxychalcone |
− | CAS_RN 6342-92-3 | + | CAS_RN 6342-92-3 |
− | FORMULA C16H14O4 | + | FORMULA C16H14O4 |
− | EXACTMASS 270.089208936 | + | EXACTMASS 270.089208936 |
− | AVERAGEMASS 270.27996 | + | AVERAGEMASS 270.27996 |
− | SMILES COc(c2)ccc(c2)C=CC(=O)c(c1)c(O)ccc(O)1 | + | SMILES COc(c2)ccc(c2)C=CC(=O)c(c1)c(O)ccc(O)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/ 20 21 0 0 0 0 0 0 0 0999 V2000 -2.8674 0.3212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8674 -0.3212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3111 -0.6424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7548 -0.3212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7548 0.3212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3111 0.6424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1985 -0.6424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6422 -0.3212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0861 -0.6422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 -0.3212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 -0.6451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5920 -0.3212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5920 0.3266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 0.6505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 0.3266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1985 -1.1437 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3111 -1.2845 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3111 1.2845 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1529 0.6504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8674 0.2379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 1 0 0 0 0 8 9 2 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 15 2 0 0 0 0 15 10 1 0 0 0 0 7 16 2 0 0 0 0 3 17 1 0 0 0 0 6 18 1 0 0 0 0 13 19 1 0 0 0 0 19 20 1 0 0 0 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 2 19 20 M SBL 1 1 20 M SMT 1 OCH3 M SBV 1 20 -5.0455 2.6250 S SKP 8 ID FL1C9ANS0002 KNApSAcK_ID C00006930 NAME 2',5'-Dihydroxy-4-methoxychalcone CAS_RN 6342-92-3 FORMULA C16H14O4 EXACTMASS 270.089208936 AVERAGEMASS 270.27996 SMILES COc(c2)ccc(c2)C=CC(=O)c(c1)c(O)ccc(O)1 M END