Mol:FLIFHXNM0001
From Metabolomics.JP
(Difference between revisions)
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− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 25 28 0 0 0 0 0 0 0 0999 V2000 | + | 25 28 0 0 0 0 0 0 0 0999 V2000 |
− | -2.0045 0.6874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0045 0.6874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.0045 0.0451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0045 0.0451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.4482 -0.2761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4482 -0.2761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.8919 0.0451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8919 0.0451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.8919 0.6874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8919 0.6874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.4482 1.0086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4482 1.0086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.3356 -0.2761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3356 -0.2761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.2207 0.0451 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | 0.2207 0.0451 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
− | 0.2207 0.6874 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | 0.2207 0.6874 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
− | -0.3356 1.0086 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3356 1.0086 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.7768 -0.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7768 -0.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.7768 -0.9628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7768 -0.9628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.3716 -1.3062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3716 -1.3062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.9664 -0.9628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9664 -0.9628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.9664 -0.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9664 -0.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.3716 0.0674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3716 0.0674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.7768 1.0085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7768 1.0085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.3356 -0.9182 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3356 -0.9182 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.3780 0.6874 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3780 0.6874 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.2207 -0.5928 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2207 -0.5928 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.5606 0.0671 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5606 0.0671 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.4482 -0.9182 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4482 -0.9182 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.5606 -0.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5606 -0.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.3617 1.3062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3617 1.3062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.8616 2.1723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8616 2.1723 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 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 5 1 0 0 0 0 | + | 10 5 1 0 0 0 0 |
− | 8 11 1 0 0 0 0 | + | 8 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 |
− | 9 17 1 0 0 0 0 | + | 9 17 1 0 0 0 0 |
− | 7 18 2 0 0 0 0 | + | 7 18 2 0 0 0 0 |
− | 16 19 1 0 0 0 0 | + | 16 19 1 0 0 0 0 |
− | 19 17 1 0 0 0 0 | + | 19 17 1 0 0 0 0 |
− | 8 20 1 0 0 0 0 | + | 8 20 1 0 0 0 0 |
− | 15 21 1 0 0 0 0 | + | 15 21 1 0 0 0 0 |
− | 3 22 1 0 0 0 0 | + | 3 22 1 0 0 0 0 |
− | 2 23 1 0 0 0 0 | + | 2 23 1 0 0 0 0 |
− | 1 24 1 0 0 0 0 | + | 1 24 1 0 0 0 0 |
− | 24 25 1 0 0 0 0 | + | 24 25 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 24 25 | + | M SAL 1 2 24 25 |
− | M SBL 1 1 27 | + | M SBL 1 1 27 |
− | M SMT 1 OCH3 | + | M SMT 1 OCH3 |
− | M SVB 1 27 -2.3617 1.3062 | + | M SVB 1 27 -2.3617 1.3062 |
− | S SKP 8 | + | S SKP 8 |
− | ID FLIFHXNM0001 | + | ID FLIFHXNM0001 |
− | KNApSAcK_ID C00009984 | + | KNApSAcK_ID C00009984 |
− | NAME Boeravinone C;4,11,12a-Trihydroxy-9-methoxy-10-methylrotenone | + | NAME Boeravinone C;4,11,12a-Trihydroxy-9-methoxy-10-methylrotenone |
− | CAS_RN 117176-19-9 | + | CAS_RN 117176-19-9 |
− | FORMULA C18H16O7 | + | FORMULA C18H16O7 |
− | EXACTMASS 344.089602866 | + | EXACTMASS 344.089602866 |
− | AVERAGEMASS 344.31543999999997 | + | AVERAGEMASS 344.31543999999997 |
− | SMILES c(c4C)(OC)cc(O3)c(c4O)C(C(C32)(c(c(OC2)1)cccc1O)O)=O | + | SMILES c(c4C)(OC)cc(O3)c(c4O)C(C(C32)(c(c(OC2)1)cccc1O)O)=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/ 25 28 0 0 0 0 0 0 0 0999 V2000 -2.0045 0.6874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0045 0.0451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4482 -0.2761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8919 0.0451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8919 0.6874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4482 1.0086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3356 -0.2761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2207 0.0451 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2207 0.6874 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3356 1.0086 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7768 -0.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7768 -0.9628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3716 -1.3062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9664 -0.9628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9664 -0.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3716 0.0674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7768 1.0085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3356 -0.9182 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 0.6874 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2207 -0.5928 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5606 0.0671 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4482 -0.9182 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5606 -0.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3617 1.3062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8616 2.1723 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 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 8 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 9 17 1 0 0 0 0 7 18 2 0 0 0 0 16 19 1 0 0 0 0 19 17 1 0 0 0 0 8 20 1 0 0 0 0 15 21 1 0 0 0 0 3 22 1 0 0 0 0 2 23 1 0 0 0 0 1 24 1 0 0 0 0 24 25 1 0 0 0 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 2 24 25 M SBL 1 1 27 M SMT 1 OCH3 M SVB 1 27 -2.3617 1.3062 S SKP 8 ID FLIFHXNM0001 KNApSAcK_ID C00009984 NAME Boeravinone C;4,11,12a-Trihydroxy-9-methoxy-10-methylrotenone CAS_RN 117176-19-9 FORMULA C18H16O7 EXACTMASS 344.089602866 AVERAGEMASS 344.31543999999997 SMILES c(c4C)(OC)cc(O3)c(c4O)C(C(C32)(c(c(OC2)1)cccc1O)O)=O M END