Mol:FL5FDCNI0004
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 28 30 0 0 0 0 0 0 0 0999 V2000 | + | 28 30 0 0 0 0 0 0 0 0999 V2000 |
| − | -2.5280 -0.1600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5280 -0.1600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5280 -0.8023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5280 -0.8023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9717 -1.1235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9717 -1.1235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4154 -0.8023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4154 -0.8023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4154 -0.1600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4154 -0.1600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9717 0.1612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9717 0.1612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8591 -1.1235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8591 -1.1235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3028 -0.8023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3028 -0.8023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3028 -0.1600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3028 -0.1600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8591 0.1612 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8591 0.1612 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8591 -1.6244 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8591 -1.6244 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2533 0.1611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2533 0.1611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8203 -0.1663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8203 -0.1663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3872 0.1611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3872 0.1611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3872 0.8158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3872 0.8158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8203 1.1431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8203 1.1431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2533 0.8158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2533 0.8158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0841 0.1611 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0841 0.1611 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9717 -1.7657 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9717 -1.7657 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8203 1.7976 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8203 1.7976 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9541 1.1430 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9541 1.1430 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9541 -0.1662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9541 -0.1662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9541 -0.8193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9541 -0.8193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5197 -1.1459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5197 -1.1459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5197 -1.7976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5197 -1.7976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0841 -0.8200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0841 -0.8200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5632 -1.3023 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5632 -1.3023 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4293 -1.8022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4293 -1.8022 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 |
| − | 16 20 1 0 0 0 0 | + | 16 20 1 0 0 0 0 |
| − | 15 21 1 0 0 0 0 | + | 15 21 1 0 0 0 0 |
| − | 14 22 1 0 0 0 0 | + | 14 22 1 0 0 0 0 |
| − | 22 23 1 0 0 0 0 | + | 22 23 1 0 0 0 0 |
| − | 23 24 2 0 0 0 0 | + | 23 24 2 0 0 0 0 |
| − | 24 25 1 0 0 0 0 | + | 24 25 1 0 0 0 0 |
| − | 24 26 1 0 0 0 0 | + | 24 26 1 0 0 0 0 |
| − | 8 27 1 0 0 0 0 | + | 8 27 1 0 0 0 0 |
| − | 27 28 1 0 0 0 0 | + | 27 28 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 27 28 | + | M SAL 1 2 27 28 |
| − | M SBL 1 1 29 | + | M SBL 1 1 29 |
| − | M SMT 1 OCH3 | + | M SMT 1 OCH3 |
| − | M SVB 1 29 -0.1039 -1.0086 | + | M SVB 1 29 -0.1039 -1.0086 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL5FDCNI0004 | + | ID FL5FDCNI0004 |
| − | KNApSAcK_ID C00005116 | + | KNApSAcK_ID C00005116 |
| − | NAME 5,7,3',4'-Tetrahydroxy-3-methoxy-5'-prenylflavone;2-[3,4-Dihydroxy-5-(3-methyl-2-butenyl)phenyl]-5,7-dihydroxy-3-methoxy-4H-1-benzopyran-4-one | + | NAME 5,7,3',4'-Tetrahydroxy-3-methoxy-5'-prenylflavone;2-[3,4-Dihydroxy-5-(3-methyl-2-butenyl)phenyl]-5,7-dihydroxy-3-methoxy-4H-1-benzopyran-4-one |
| − | CAS_RN 150853-98-8 | + | CAS_RN 150853-98-8 |
| − | FORMULA C21H20O7 | + | FORMULA C21H20O7 |
| − | EXACTMASS 384.120902994 | + | EXACTMASS 384.120902994 |
| − | AVERAGEMASS 384.37929999999994 | + | AVERAGEMASS 384.37929999999994 |
| − | SMILES O(c21)C(c(c3)cc(c(O)c(O)3)CC=C(C)C)=C(C(=O)c1c(cc(O)c2)O)OC | + | SMILES O(c21)C(c(c3)cc(c(O)c(O)3)CC=C(C)C)=C(C(=O)c1c(cc(O)c2)O)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/
28 30 0 0 0 0 0 0 0 0999 V2000
-2.5280 -0.1600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5280 -0.8023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9717 -1.1235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4154 -0.8023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4154 -0.1600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9717 0.1612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8591 -1.1235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3028 -0.8023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3028 -0.1600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8591 0.1612 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8591 -1.6244 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2533 0.1611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8203 -0.1663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3872 0.1611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3872 0.8158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8203 1.1431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2533 0.8158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0841 0.1611 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9717 -1.7657 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8203 1.7976 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9541 1.1430 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9541 -0.1662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9541 -0.8193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5197 -1.1459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5197 -1.7976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0841 -0.8200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5632 -1.3023 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4293 -1.8022 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
16 20 1 0 0 0 0
15 21 1 0 0 0 0
14 22 1 0 0 0 0
22 23 1 0 0 0 0
23 24 2 0 0 0 0
24 25 1 0 0 0 0
24 26 1 0 0 0 0
8 27 1 0 0 0 0
27 28 1 0 0 0 0
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 27 28
M SBL 1 1 29
M SMT 1 OCH3
M SVB 1 29 -0.1039 -1.0086
S SKP 8
ID FL5FDCNI0004
KNApSAcK_ID C00005116
NAME 5,7,3',4'-Tetrahydroxy-3-methoxy-5'-prenylflavone;2-[3,4-Dihydroxy-5-(3-methyl-2-butenyl)phenyl]-5,7-dihydroxy-3-methoxy-4H-1-benzopyran-4-one
CAS_RN 150853-98-8
FORMULA C21H20O7
EXACTMASS 384.120902994
AVERAGEMASS 384.37929999999994
SMILES O(c21)C(c(c3)cc(c(O)c(O)3)CC=C(C)C)=C(C(=O)c1c(cc(O)c2)O)OC
M END
