Mol:FLIDHYNS0002
From Metabolomics.JP
(Difference between revisions)
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− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 24 28 0 0 0 0 0 0 0 0999 V2000 | + | 24 28 0 0 0 0 0 0 0 0999 V2000 |
− | -2.3353 0.6874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3353 0.6874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.3353 0.0451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3353 0.0451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.7790 -0.2761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7790 -0.2761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.2227 0.0451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2227 0.0451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.2227 0.6874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2227 0.6874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.7790 1.0086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7790 1.0086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.6664 -0.2761 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | -0.6664 -0.2761 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
− | -0.1101 0.0451 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | -0.1101 0.0451 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
− | -0.1101 0.6874 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | -0.1101 0.6874 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
− | -0.6664 1.0086 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6664 1.0086 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.4460 -0.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4460 -0.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.4460 -0.9628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4460 -0.9628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.0408 -1.3062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0408 -1.3062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.6356 -0.9628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6356 -0.9628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.6356 -0.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6356 -0.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.0408 0.0674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0408 0.0674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.6646 -0.9626 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6646 -0.9626 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.2888 -1.1750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2888 -1.1750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.6925 -0.6194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6925 -0.6194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.2888 -0.0638 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2888 -0.0638 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.4460 1.0085 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4460 1.0085 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.1605 0.5960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1605 0.5960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.6925 1.3062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6925 1.3062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.1924 2.1723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1924 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 |
− | 7 17 1 0 0 0 0 | + | 7 17 1 0 0 0 0 |
− | 12 17 1 0 0 0 0 | + | 12 17 1 0 0 0 0 |
− | 14 18 1 0 0 0 0 | + | 14 18 1 0 0 0 0 |
− | 18 19 1 0 0 0 0 | + | 18 19 1 0 0 0 0 |
− | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
− | 20 15 1 0 0 0 0 | + | 20 15 1 0 0 0 0 |
− | 9 21 1 0 0 0 0 | + | 9 21 1 0 0 0 0 |
− | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
− | 1 23 1 0 0 0 0 | + | 1 23 1 0 0 0 0 |
− | 23 24 1 0 0 0 0 | + | 23 24 1 0 0 0 0 |
− | M STY 1 2 SUP | + | M STY 1 2 SUP |
− | M SLB 1 2 2 | + | M SLB 1 2 2 |
− | M SAL 2 2 23 24 | + | M SAL 2 2 23 24 |
− | M SBL 2 1 27 | + | M SBL 2 1 27 |
− | M SMT 2 OCH3 | + | M SMT 2 OCH3 |
− | M SVB 2 27 -2.6925 1.3062 | + | M SVB 2 27 -2.6925 1.3062 |
− | 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 25 | + | M SBL 1 1 25 |
− | M SMT 1 OCH3 | + | M SMT 1 OCH3 |
− | M SVB 1 25 0.446 1.0085 | + | M SVB 1 25 0.446 1.0085 |
− | S SKP 8 | + | S SKP 8 |
− | ID FLIDHYNS0002 | + | ID FLIDHYNS0002 |
− | KNApSAcK_ID C00010005 | + | KNApSAcK_ID C00010005 |
− | NAME 6-Methoxypterocarpin;(6S,6aS,11aR)-3,6-Dimethoxy-8,9-methylenedioxypterocarpan | + | NAME 6-Methoxypterocarpin;(6S,6aS,11aR)-3,6-Dimethoxy-8,9-methylenedioxypterocarpan |
− | CAS_RN 90686-10-5 | + | CAS_RN 90686-10-5 |
− | FORMULA C18H16O6 | + | FORMULA C18H16O6 |
− | EXACTMASS 328.094688244 | + | EXACTMASS 328.094688244 |
− | AVERAGEMASS 328.31604 | + | AVERAGEMASS 328.31604 |
− | SMILES c(c45)c(O1)c(cc4OCO5)C(C3OC)C1c(c(O3)2)ccc(OC)c2 | + | SMILES c(c45)c(O1)c(cc4OCO5)C(C3OC)C1c(c(O3)2)ccc(OC)c2 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/ 24 28 0 0 0 0 0 0 0 0999 V2000 -2.3353 0.6874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3353 0.0451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7790 -0.2761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2227 0.0451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2227 0.6874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7790 1.0086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6664 -0.2761 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1101 0.0451 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1101 0.6874 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6664 1.0086 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 -0.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 -0.9628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0408 -1.3062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6356 -0.9628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6356 -0.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0408 0.0674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6646 -0.9626 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2888 -1.1750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6925 -0.6194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2888 -0.0638 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 1.0085 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1605 0.5960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6925 1.3062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1924 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 7 17 1 0 0 0 0 12 17 1 0 0 0 0 14 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 15 1 0 0 0 0 9 21 1 0 0 0 0 21 22 1 0 0 0 0 1 23 1 0 0 0 0 23 24 1 0 0 0 0 M STY 1 2 SUP M SLB 1 2 2 M SAL 2 2 23 24 M SBL 2 1 27 M SMT 2 OCH3 M SVB 2 27 -2.6925 1.3062 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 2 21 22 M SBL 1 1 25 M SMT 1 OCH3 M SVB 1 25 0.446 1.0085 S SKP 8 ID FLIDHYNS0002 KNApSAcK_ID C00010005 NAME 6-Methoxypterocarpin;(6S,6aS,11aR)-3,6-Dimethoxy-8,9-methylenedioxypterocarpan CAS_RN 90686-10-5 FORMULA C18H16O6 EXACTMASS 328.094688244 AVERAGEMASS 328.31604 SMILES c(c45)c(O1)c(cc4OCO5)C(C3OC)C1c(c(O3)2)ccc(OC)c2 M END