Mol:FL2F1ANI0002
From Metabolomics.JP
(Difference between revisions)
Line 1: | Line 1: | ||
− | + | ||
− | + | ||
− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 29 31 0 0 0 0 0 0 0 0999 V2000 | + | 29 31 0 0 0 0 0 0 0 0999 V2000 |
− | -1.1318 -0.3227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1318 -0.3227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.1318 -0.9651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1318 -0.9651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.5755 -1.2863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5755 -1.2863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.0192 -0.9651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0192 -0.9651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.0192 -0.3227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0192 -0.3227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.5755 -0.0015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5755 -0.0015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.5371 -1.2863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5371 -1.2863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.0934 -0.9651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0934 -0.9651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.0934 -0.3227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0934 -0.3227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.5371 -0.0015 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5371 -0.0015 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.6495 -0.0017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6495 -0.0017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.2165 -0.3290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2165 -0.3290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.7834 -0.0017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7834 -0.0017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.7834 0.6530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7834 0.6530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.2165 0.9804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2165 0.9804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.6495 0.6530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6495 0.6530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.5371 -1.8300 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5371 -1.8300 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.6881 -0.0015 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6881 -0.0015 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.3503 0.9803 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3503 0.9803 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.5755 0.6406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5755 0.6406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.1316 0.9616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1316 0.9616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.1316 1.6038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1316 1.6038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.6877 1.9248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6877 1.9248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.5755 1.9248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5755 1.9248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.6879 -1.2861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6879 -1.2861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.2428 -0.9658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2428 -0.9658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.7965 -1.2855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7965 -1.2855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.3503 -0.9658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3503 -0.9658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.7965 -1.9248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7965 -1.9248 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 |
− | 9 11 1 0 0 0 0 | + | 9 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 |
− | 18 1 1 0 0 0 0 | + | 18 1 1 0 0 0 0 |
− | 14 19 1 0 0 0 0 | + | 14 19 1 0 0 0 0 |
− | 6 20 1 0 0 0 0 | + | 6 20 1 0 0 0 0 |
− | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
− | 21 22 2 0 0 0 0 | + | 21 22 2 0 0 0 0 |
− | 22 23 1 0 0 0 0 | + | 22 23 1 0 0 0 0 |
− | 22 24 1 0 0 0 0 | + | 22 24 1 0 0 0 0 |
− | 2 25 1 0 0 0 0 | + | 2 25 1 0 0 0 0 |
− | 25 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
− | 26 27 2 0 0 0 0 | + | 26 27 2 0 0 0 0 |
− | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
− | 27 29 1 0 0 0 0 | + | 27 29 1 0 0 0 0 |
− | S SKP 8 | + | S SKP 8 |
− | ID FL2F1ANI0002 | + | ID FL2F1ANI0002 |
− | KNApSAcK_ID C00008196 | + | KNApSAcK_ID C00008196 |
− | NAME 7,4'-Dihydroxy-6,8-di-C-prenylflavanone | + | NAME 7,4'-Dihydroxy-6,8-di-C-prenylflavanone |
− | CAS_RN 78316-25-3 | + | CAS_RN 78316-25-3 |
− | FORMULA C25H28O4 | + | FORMULA C25H28O4 |
− | EXACTMASS 392.19875938399997 | + | EXACTMASS 392.19875938399997 |
− | AVERAGEMASS 392.48742 | + | AVERAGEMASS 392.48742 |
− | SMILES c(CC=C(C)C)(c(O)3)cc(c1c3CC=C(C)C)C(CC(c(c2)ccc(c2)O)O1)=O | + | SMILES c(CC=C(C)C)(c(O)3)cc(c1c3CC=C(C)C)C(CC(c(c2)ccc(c2)O)O1)=O |
M END | M END | ||
− |
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/ 29 31 0 0 0 0 0 0 0 0999 V2000 -1.1318 -0.3227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1318 -0.9651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5755 -1.2863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0192 -0.9651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0192 -0.3227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5755 -0.0015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5371 -1.2863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0934 -0.9651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0934 -0.3227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5371 -0.0015 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6495 -0.0017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2165 -0.3290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7834 -0.0017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7834 0.6530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2165 0.9804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6495 0.6530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5371 -1.8300 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6881 -0.0015 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3503 0.9803 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5755 0.6406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1316 0.9616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1316 1.6038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6877 1.9248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5755 1.9248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6879 -1.2861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2428 -0.9658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7965 -1.2855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3503 -0.9658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7965 -1.9248 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 9 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 18 1 1 0 0 0 0 14 19 1 0 0 0 0 6 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 2 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 S SKP 8 ID FL2F1ANI0002 KNApSAcK_ID C00008196 NAME 7,4'-Dihydroxy-6,8-di-C-prenylflavanone CAS_RN 78316-25-3 FORMULA C25H28O4 EXACTMASS 392.19875938399997 AVERAGEMASS 392.48742 SMILES c(CC=C(C)C)(c(O)3)cc(c1c3CC=C(C)C)C(CC(c(c2)ccc(c2)O)O1)=O M END