Mol:FL3FADNI0002
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 27 29 0 0 0 0 0 0 0 0999 V2000 | + | 27 29 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.1300 -0.1368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1300 -0.1368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1300 -0.7791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1300 -0.7791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5737 -1.1003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5737 -1.1003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0174 -0.7791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0174 -0.7791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0174 -0.1368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0174 -0.1368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5737 0.1844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5737 0.1844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5389 -1.1003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5389 -1.1003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0952 -0.7791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0952 -0.7791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0952 -0.1368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0952 -0.1368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5389 0.1844 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5389 0.1844 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5389 -1.6012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5389 -1.6012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6513 0.1843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6513 0.1843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2182 -0.1431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2182 -0.1431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7852 0.1843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7852 0.1843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7852 0.8390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7852 0.8390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2182 1.1663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2182 1.1663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6513 0.8390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6513 0.8390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6861 0.1843 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6861 0.1843 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5737 -1.7424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5737 -1.7424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6861 -1.1002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6861 -1.1002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2422 -0.7791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2422 -0.7791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7971 -1.0995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7971 -1.0995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3520 -0.7791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3520 -0.7791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7971 -1.7403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7971 -1.7403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7852 0.8390 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7852 0.8390 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5017 1.7424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5017 1.7424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9432 2.6396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9432 2.6396 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 5 1 0 0 0 0 | + | 10 5 1 0 0 0 0 |
| − | 7 11 2 0 0 0 0 | + | 7 11 2 0 0 0 0 |
| − | 9 12 1 0 0 0 0 | + | 9 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 16 1 0 0 0 0 | + | 15 16 1 0 0 0 0 |
| − | 16 17 2 0 0 0 0 | + | 16 17 2 0 0 0 0 |
| − | 17 12 1 0 0 0 0 | + | 17 12 1 0 0 0 0 |
| − | 1 18 1 0 0 0 0 | + | 1 18 1 0 0 0 0 |
| − | 3 19 1 0 0 0 0 | + | 3 19 1 0 0 0 0 |
| − | 2 20 1 0 0 0 0 | + | 2 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 |
| − | 15 25 1 0 0 0 0 | + | 15 25 1 0 0 0 0 |
| − | 16 26 1 0 0 0 0 | + | 16 26 1 0 0 0 0 |
| − | 26 27 1 0 0 0 0 | + | 26 27 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 26 27 | + | M SAL 1 2 26 27 |
| − | M SBL 1 1 28 | + | M SBL 1 1 28 |
| − | M SMT 1 OCH3 | + | M SMT 1 OCH3 |
| − | M SVB 1 28 2.5017 1.7424 | + | M SVB 1 28 2.5017 1.7424 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL3FADNI0002 | + | ID FL3FADNI0002 |
| − | KNApSAcK_ID C00004036 | + | KNApSAcK_ID C00004036 |
| − | NAME Cannflavin B;6-Prenylchrysoeriol;Canniflavone;Canniflavone 1;5,7-Dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-6-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one | + | NAME Cannflavin B;6-Prenylchrysoeriol;Canniflavone;Canniflavone 1;5,7-Dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-6-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one |
| − | CAS_RN 76735-58-5 | + | CAS_RN 76735-58-5 |
| − | FORMULA C21H20O6 | + | FORMULA C21H20O6 |
| − | EXACTMASS 368.125988372 | + | EXACTMASS 368.125988372 |
| − | AVERAGEMASS 368.37989999999996 | + | AVERAGEMASS 368.37989999999996 |
| − | SMILES c(c1)(C(=C3)Oc(c2)c(C(=O)3)c(c(CC=C(C)C)c(O)2)O)cc(c(O)c1)OC | + | SMILES c(c1)(C(=C3)Oc(c2)c(C(=O)3)c(c(CC=C(C)C)c(O)2)O)cc(c(O)c1)OC |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
27 29 0 0 0 0 0 0 0 0999 V2000
-1.1300 -0.1368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1300 -0.7791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5737 -1.1003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0174 -0.7791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0174 -0.1368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5737 0.1844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5389 -1.1003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0952 -0.7791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0952 -0.1368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5389 0.1844 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5389 -1.6012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6513 0.1843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2182 -0.1431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7852 0.1843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7852 0.8390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2182 1.1663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6513 0.8390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6861 0.1843 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5737 -1.7424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6861 -1.1002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2422 -0.7791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7971 -1.0995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3520 -0.7791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7971 -1.7403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7852 0.8390 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5017 1.7424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.9432 2.6396 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 5 1 0 0 0 0
7 11 2 0 0 0 0
9 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 16 1 0 0 0 0
16 17 2 0 0 0 0
17 12 1 0 0 0 0
1 18 1 0 0 0 0
3 19 1 0 0 0 0
2 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
15 25 1 0 0 0 0
16 26 1 0 0 0 0
26 27 1 0 0 0 0
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 26 27
M SBL 1 1 28
M SMT 1 OCH3
M SVB 1 28 2.5017 1.7424
S SKP 8
ID FL3FADNI0002
KNApSAcK_ID C00004036
NAME Cannflavin B;6-Prenylchrysoeriol;Canniflavone;Canniflavone 1;5,7-Dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-6-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one
CAS_RN 76735-58-5
FORMULA C21H20O6
EXACTMASS 368.125988372
AVERAGEMASS 368.37989999999996
SMILES c(c1)(C(=C3)Oc(c2)c(C(=O)3)c(c(CC=C(C)C)c(O)2)O)cc(c(O)c1)OC
M END
