Mol:FLIFWYNM0001
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 23 26 0 0 0 0 0 0 0 0999 V2000 | + | 23 26 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.7073 0.4548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7073 0.4548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7073 -0.1876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7073 -0.1876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1510 -0.5088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1510 -0.5088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5947 -0.1876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5947 -0.1876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5947 0.4548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5947 0.4548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1510 0.7759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1510 0.7759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0384 -0.5088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0384 -0.5088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5179 -0.1876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5179 -0.1876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5179 0.4548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5179 0.4548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0384 0.7759 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0384 0.7759 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0740 -0.5087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0740 -0.5087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0740 -1.1955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0740 -1.1955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6688 -1.5389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6688 -1.5389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2636 -1.1955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2636 -1.1955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2636 -0.5087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2636 -0.5087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6688 -0.1653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6688 -0.1653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0740 0.7758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0740 0.7758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0384 -1.1509 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0384 -1.1509 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6752 0.4548 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6752 0.4548 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2636 0.7759 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2636 0.7759 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1510 -1.1509 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1510 -1.1509 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0834 1.5389 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0834 1.5389 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2634 -0.5087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2634 -0.5087 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 |
| − | 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 |
| − | 9 17 1 0 0 0 0 | + | 9 17 1 0 0 0 0 |
| − | 7 18 2 0 0 0 0 | + | 7 18 2 0 0 0 0 |
| − | 16 19 1 0 0 0 0 | + | 16 19 1 0 0 0 0 |
| − | 19 17 1 0 0 0 0 | + | 19 17 1 0 0 0 0 |
| − | 20 1 1 0 0 0 0 | + | 20 1 1 0 0 0 0 |
| − | 3 21 1 0 0 0 0 | + | 3 21 1 0 0 0 0 |
| − | 17 22 1 0 0 0 0 | + | 17 22 1 0 0 0 0 |
| − | 2 23 1 0 0 0 0 | + | 2 23 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FLIFWYNM0001 | + | ID FLIFWYNM0001 |
| − | KNApSAcK_ID C00009989 | + | KNApSAcK_ID C00009989 |
| − | NAME Boeravinone B;6a,12a-Dehydro-6,9,11-trihydroxy-10-methylrotenone | + | NAME Boeravinone B;6a,12a-Dehydro-6,9,11-trihydroxy-10-methylrotenone |
| − | CAS_RN 114567-34-9 | + | CAS_RN 114567-34-9 |
| − | FORMULA C17H12O6 | + | FORMULA C17H12O6 |
| − | EXACTMASS 312.063388116 | + | EXACTMASS 312.063388116 |
| − | AVERAGEMASS 312.27358 | + | AVERAGEMASS 312.27358 |
| − | SMILES Oc(c4)c(C)c(O)c(c43)C(=O)C(c21)=C(O3)C(O)Oc(cccc2)1 | + | SMILES Oc(c4)c(C)c(O)c(c43)C(=O)C(c21)=C(O3)C(O)Oc(cccc2)1 |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
23 26 0 0 0 0 0 0 0 0999 V2000
-1.7073 0.4548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7073 -0.1876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1510 -0.5088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5947 -0.1876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5947 0.4548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1510 0.7759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0384 -0.5088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5179 -0.1876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5179 0.4548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0384 0.7759 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0740 -0.5087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0740 -1.1955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6688 -1.5389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2636 -1.1955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2636 -0.5087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6688 -0.1653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0740 0.7758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0384 -1.1509 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6752 0.4548 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.2636 0.7759 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1510 -1.1509 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0834 1.5389 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.2634 -0.5087 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
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
9 17 1 0 0 0 0
7 18 2 0 0 0 0
16 19 1 0 0 0 0
19 17 1 0 0 0 0
20 1 1 0 0 0 0
3 21 1 0 0 0 0
17 22 1 0 0 0 0
2 23 1 0 0 0 0
S SKP 8
ID FLIFWYNM0001
KNApSAcK_ID C00009989
NAME Boeravinone B;6a,12a-Dehydro-6,9,11-trihydroxy-10-methylrotenone
CAS_RN 114567-34-9
FORMULA C17H12O6
EXACTMASS 312.063388116
AVERAGEMASS 312.27358
SMILES Oc(c4)c(C)c(O)c(c43)C(=O)C(c21)=C(O3)C(O)Oc(cccc2)1
M END
