Mol:FL2F19NS0001
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 18 20 0 0 0 0 0 0 0 0999 V2000 | + | 18 20 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.6796 0.1021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6796 0.1021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6796 -0.5402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6796 -0.5402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1233 -0.8614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1233 -0.8614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5670 -0.5402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5670 -0.5402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5670 0.1021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5670 0.1021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1233 0.4233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1233 0.4233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0107 -0.8614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0107 -0.8614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5456 -0.5402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5456 -0.5402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5456 0.1021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5456 0.1021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0107 0.4233 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0107 0.4233 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1017 0.4232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1017 0.4232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6687 0.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6687 0.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2357 0.4232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2357 0.4232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2357 1.0779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2357 1.0779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6687 1.4052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6687 1.4052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1017 1.0779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1017 1.0779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2357 0.4232 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2357 0.4232 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0107 -1.4052 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0107 -1.4052 0.0000 O 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 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 |
| − | 1 17 1 0 0 0 0 | + | 1 17 1 0 0 0 0 |
| − | 7 18 2 0 0 0 0 | + | 7 18 2 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2F19NS0001 | + | ID FL2F19NS0001 |
| − | KNApSAcK_ID C00008126 | + | KNApSAcK_ID C00008126 |
| − | NAME 7-Hydroxyflavanone | + | NAME 7-Hydroxyflavanone |
| − | CAS_RN 6515-36-2 | + | CAS_RN 6515-36-2 |
| − | FORMULA C15H12O3 | + | FORMULA C15H12O3 |
| − | EXACTMASS 240.07864425 | + | EXACTMASS 240.07864425 |
| − | AVERAGEMASS 240.25398 | + | AVERAGEMASS 240.25398 |
| − | SMILES Oc(c3)cc(O1)c(c3)C(=O)CC1c(c2)cccc2 | + | SMILES Oc(c3)cc(O1)c(c3)C(=O)CC1c(c2)cccc2 |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
18 20 0 0 0 0 0 0 0 0999 V2000
-1.6796 0.1021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6796 -0.5402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1233 -0.8614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5670 -0.5402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5670 0.1021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1233 0.4233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0107 -0.8614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5456 -0.5402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5456 0.1021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0107 0.4233 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1017 0.4232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6687 0.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2357 0.4232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2357 1.0779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6687 1.4052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1017 1.0779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2357 0.4232 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0107 -1.4052 0.0000 O 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 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
1 17 1 0 0 0 0
7 18 2 0 0 0 0
S SKP 8
ID FL2F19NS0001
KNApSAcK_ID C00008126
NAME 7-Hydroxyflavanone
CAS_RN 6515-36-2
FORMULA C15H12O3
EXACTMASS 240.07864425
AVERAGEMASS 240.25398
SMILES Oc(c3)cc(O1)c(c3)C(=O)CC1c(c2)cccc2
M END
