Mol:FL2FAANI0002
From Metabolomics.JP
(Difference between revisions)
| Line 1: | Line 1: | ||
| − | + | ||
| − | + | ||
| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 31 33 0 0 0 0 0 0 0 0999 V2000 | + | 31 33 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.0217 -0.3387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0217 -0.3387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0217 -0.9166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0217 -0.9166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5212 -1.2055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5212 -1.2055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0208 -0.9166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0208 -0.9166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0208 -0.3387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0208 -0.3387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5212 -0.0498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5212 -0.0498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4797 -1.2055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4797 -1.2055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9801 -0.9166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9801 -0.9166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9801 -0.3387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9801 -0.3387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4797 -0.0498 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4797 -0.0498 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4803 -0.0499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4803 -0.0499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9946 -0.3469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9946 -0.3469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5090 -0.0499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5090 -0.0499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5090 0.5440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5090 0.5440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9946 0.8409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9946 0.8409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4803 0.5440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4803 0.5440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9801 0.3419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9801 0.3419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.5218 -0.0499 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5218 -0.0499 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5212 -1.7830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5212 -1.7830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4797 -1.7830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4797 -1.7830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5212 0.5277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5212 0.5277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.5218 -1.2053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5218 -1.2053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0219 -0.9166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0219 -0.9166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5221 -1.2053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5221 -1.2053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0222 -0.9166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0222 -0.9166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5221 -1.7828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5221 -1.7828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0222 0.8403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0222 0.8403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0091 0.8094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0091 0.8094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0091 1.5438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0091 1.5438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5949 1.7830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5949 1.7830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3809 1.7585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3809 1.7585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1 2 2 0 0 0 0 | + | 1 2 2 0 0 0 0 |
| − | 2 3 1 0 0 0 0 | + | 2 3 1 0 0 0 0 |
| − | 3 4 2 0 0 0 0 | + | 3 4 2 0 0 0 0 |
| − | 4 5 1 0 0 0 0 | + | 4 5 1 0 0 0 0 |
| − | 5 6 2 0 0 0 0 | + | 5 6 2 0 0 0 0 |
| − | 6 1 1 0 0 0 0 | + | 6 1 1 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 |
| − | 9 17 1 1 0 0 0 | + | 9 17 1 1 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 |
| − | 7 20 2 0 0 0 0 | + | 7 20 2 0 0 0 0 |
| − | 6 21 1 0 0 0 0 | + | 6 21 1 0 0 0 0 |
| − | 2 22 1 0 0 0 0 | + | 2 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 |
| − | 14 27 1 0 0 0 0 | + | 14 27 1 0 0 0 0 |
| − | 21 28 1 0 0 0 0 | + | 21 28 1 0 0 0 0 |
| − | 28 29 2 0 0 0 0 | + | 28 29 2 0 0 0 0 |
| − | 29 30 1 0 0 0 0 | + | 29 30 1 0 0 0 0 |
| − | 29 31 1 0 0 0 0 | + | 29 31 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FAANI0002 | + | ID FL2FAANI0002 |
| − | KNApSAcK_ID C00000954 | + | KNApSAcK_ID C00000954 |
| − | NAME 6,8-Diprenylnaringenin;Lonchocarpol A;Senegalensein | + | NAME 6,8-Diprenylnaringenin;Lonchocarpol A;Senegalensein |
| − | CAS_RN 68236-11-3 | + | CAS_RN 68236-11-3 |
| − | FORMULA C25H28O5 | + | FORMULA C25H28O5 |
| − | EXACTMASS 408.193674006 | + | EXACTMASS 408.193674006 |
| − | AVERAGEMASS 408.48682 | + | AVERAGEMASS 408.48682 |
| − | SMILES [H]C(c(c3)ccc(c3)O)(O2)CC(=O)c(c12)c(O)c(CC=C(C)C)c(c1CC=C(C)C)O | + | SMILES [H]C(c(c3)ccc(c3)O)(O2)CC(=O)c(c12)c(O)c(CC=C(C)C)c(c1CC=C(C)C)O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
31 33 0 0 0 0 0 0 0 0999 V2000
-1.0217 -0.3387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0217 -0.9166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5212 -1.2055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0208 -0.9166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0208 -0.3387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5212 -0.0498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4797 -1.2055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9801 -0.9166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9801 -0.3387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4797 -0.0498 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4803 -0.0499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9946 -0.3469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5090 -0.0499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5090 0.5440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9946 0.8409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4803 0.5440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9801 0.3419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5218 -0.0499 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5212 -1.7830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4797 -1.7830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5212 0.5277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5218 -1.2053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0219 -0.9166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5221 -1.2053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0222 -0.9166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5221 -1.7828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0222 0.8403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0091 0.8094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0091 1.5438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5949 1.7830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3809 1.7585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
2 3 1 0 0 0 0
3 4 2 0 0 0 0
4 5 1 0 0 0 0
5 6 2 0 0 0 0
6 1 1 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
9 17 1 1 0 0 0
1 18 1 0 0 0 0
3 19 1 0 0 0 0
7 20 2 0 0 0 0
6 21 1 0 0 0 0
2 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
14 27 1 0 0 0 0
21 28 1 0 0 0 0
28 29 2 0 0 0 0
29 30 1 0 0 0 0
29 31 1 0 0 0 0
S SKP 8
ID FL2FAANI0002
KNApSAcK_ID C00000954
NAME 6,8-Diprenylnaringenin;Lonchocarpol A;Senegalensein
CAS_RN 68236-11-3
FORMULA C25H28O5
EXACTMASS 408.193674006
AVERAGEMASS 408.48682
SMILES [H]C(c(c3)ccc(c3)O)(O2)CC(=O)c(c12)c(O)c(CC=C(C)C)c(c1CC=C(C)C)O
M END
