Mol:FL3FALNI0009
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 32 34 0 0 0 0 0 0 0 0999 V2000 | + | 32 34 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.1300 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1300 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1300 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1300 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5737 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5737 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0174 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0174 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0174 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0174 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5737 0.4725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5737 0.4725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5389 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5389 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0952 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0952 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0952 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0952 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5389 0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5389 0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5389 -1.3131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5389 -1.3131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6513 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6513 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2182 0.1450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2182 0.1450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7852 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7852 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7852 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7852 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2182 1.4544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2182 1.4544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6513 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6513 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5737 -1.4544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5737 -1.4544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6861 -0.8121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6861 -0.8121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2422 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2422 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7971 -0.8114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7971 -0.8114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3520 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3520 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7971 -1.4522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7971 -1.4522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3520 1.4543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3520 1.4543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0845 1.4543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0845 1.4543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6513 -0.8121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6513 -0.8121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2074 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2074 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7623 -0.8114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7623 -0.8114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3172 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3172 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7623 -1.4522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7623 -1.4522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4873 0.7700 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4873 0.7700 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9874 1.6360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9874 1.6360 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 |
| − | 3 18 1 0 0 0 0 | + | 3 18 1 0 0 0 0 |
| − | 2 19 1 0 0 0 0 | + | 2 19 1 0 0 0 0 |
| − | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
| − | 20 21 2 0 0 0 0 | + | 20 21 2 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
| − | 21 23 1 0 0 0 0 | + | 21 23 1 0 0 0 0 |
| − | 15 24 1 0 0 0 0 | + | 15 24 1 0 0 0 0 |
| − | 17 25 1 0 0 0 0 | + | 17 25 1 0 0 0 0 |
| − | 8 26 1 0 0 0 0 | + | 8 26 1 0 0 0 0 |
| − | 26 27 1 0 0 0 0 | + | 26 27 1 0 0 0 0 |
| − | 27 28 2 0 0 0 0 | + | 27 28 2 0 0 0 0 |
| − | 28 29 1 0 0 0 0 | + | 28 29 1 0 0 0 0 |
| − | 28 30 1 0 0 0 0 | + | 28 30 1 0 0 0 0 |
| − | 1 31 1 0 0 0 0 | + | 1 31 1 0 0 0 0 |
| − | 31 32 1 0 0 0 0 | + | 31 32 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 31 32 | + | M SAL 1 2 31 32 |
| − | M SBL 1 1 33 | + | M SBL 1 1 33 |
| − | M SMT 1 OCH3 | + | M SMT 1 OCH3 |
| − | M SVB 1 33 -1.4873 0.77 | + | M SVB 1 33 -1.4873 0.77 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL3FALNI0009 | + | ID FL3FALNI0009 |
| − | KNApSAcK_ID C00004032 | + | KNApSAcK_ID C00004032 |
| − | NAME Artocarpin;2',4',5-Trihydroxy-7-methoxy-6-(3-methyl-1-butenyl)-3-(3-methyl-2-butenyl)flavone;2-(2,4-Dihydroxyphenyl)-5-hydroxy-7-methoxy-6-(3-methyl-1-butenyl)-3-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one | + | NAME Artocarpin;2',4',5-Trihydroxy-7-methoxy-6-(3-methyl-1-butenyl)-3-(3-methyl-2-butenyl)flavone;2-(2,4-Dihydroxyphenyl)-5-hydroxy-7-methoxy-6-(3-methyl-1-butenyl)-3-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one |
| − | CAS_RN 7608-44-8 | + | CAS_RN 7608-44-8 |
| − | FORMULA C26H28O6 | + | FORMULA C26H28O6 |
| − | EXACTMASS 436.188588628 | + | EXACTMASS 436.188588628 |
| − | AVERAGEMASS 436.49692 | + | AVERAGEMASS 436.49692 |
| − | SMILES C(C3=O)(=C(Oc(c32)cc(OC)c(c2O)CC=C(C)C)c(c1)c(O)cc(c1)O)CC=C(C)C | + | SMILES C(C3=O)(=C(Oc(c32)cc(OC)c(c2O)CC=C(C)C)c(c1)c(O)cc(c1)O)CC=C(C)C |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
32 34 0 0 0 0 0 0 0 0999 V2000
-1.1300 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1300 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5737 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0174 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0174 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5737 0.4725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5389 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0952 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0952 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5389 0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5389 -1.3131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6513 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2182 0.1450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7852 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7852 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2182 1.4544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6513 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5737 -1.4544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6861 -0.8121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2422 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7971 -0.8114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3520 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7971 -1.4522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3520 1.4543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0845 1.4543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6513 -0.8121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2074 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7623 -0.8114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3172 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7623 -1.4522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4873 0.7700 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9874 1.6360 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
3 18 1 0 0 0 0
2 19 1 0 0 0 0
19 20 1 0 0 0 0
20 21 2 0 0 0 0
21 22 1 0 0 0 0
21 23 1 0 0 0 0
15 24 1 0 0 0 0
17 25 1 0 0 0 0
8 26 1 0 0 0 0
26 27 1 0 0 0 0
27 28 2 0 0 0 0
28 29 1 0 0 0 0
28 30 1 0 0 0 0
1 31 1 0 0 0 0
31 32 1 0 0 0 0
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 31 32
M SBL 1 1 33
M SMT 1 OCH3
M SVB 1 33 -1.4873 0.77
S SKP 8
ID FL3FALNI0009
KNApSAcK_ID C00004032
NAME Artocarpin;2',4',5-Trihydroxy-7-methoxy-6-(3-methyl-1-butenyl)-3-(3-methyl-2-butenyl)flavone;2-(2,4-Dihydroxyphenyl)-5-hydroxy-7-methoxy-6-(3-methyl-1-butenyl)-3-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one
CAS_RN 7608-44-8
FORMULA C26H28O6
EXACTMASS 436.188588628
AVERAGEMASS 436.49692
SMILES C(C3=O)(=C(Oc(c32)cc(OC)c(c2O)CC=C(C)C)c(c1)c(O)cc(c1)O)CC=C(C)C
M END
