Mol:FL1D99NS0001
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 16 17 0 0 0 0 0 0 0 0999 V2000 | + | 16 17 0 0 0 0 0 0 0 0999 V2000 |
| − | -2.1962 0.6388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1962 0.6388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1962 -0.0009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1962 -0.0009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6422 -0.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6422 -0.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0882 -0.0009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0882 -0.0009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0882 0.6388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0882 0.6388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6422 0.9586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6422 0.9586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5345 -0.3206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5345 -0.3206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0180 -0.0016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0180 -0.0016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5693 -0.3199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5693 -0.3199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1195 -0.0023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1195 -0.0023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6579 -0.3131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6579 -0.3131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1962 -0.0023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1962 -0.0023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1962 0.6194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1962 0.6194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6579 0.9302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6579 0.9302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1195 0.6194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1195 0.6194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5345 -0.9586 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5345 -0.9586 0.0000 O 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 11 2 0 0 0 0 | + | 10 11 2 0 0 0 0 |
| − | 11 12 1 0 0 0 0 | + | 11 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 10 1 0 0 0 0 | + | 15 10 1 0 0 0 0 |
| − | 7 16 2 0 0 0 0 | + | 7 16 2 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL1D99NS0001 | + | ID FL1D99NS0001 |
| − | KNApSAcK_ID C00007921 | + | KNApSAcK_ID C00007921 |
| − | NAME Dihydrochalcone | + | NAME Dihydrochalcone |
| − | CAS_RN 1083-30-3 | + | CAS_RN 1083-30-3 |
| − | FORMULA C15H14O | + | FORMULA C15H14O |
| − | EXACTMASS 210.10446507 | + | EXACTMASS 210.10446507 |
| − | AVERAGEMASS 210.27106000000003 | + | AVERAGEMASS 210.27106000000003 |
| − | SMILES O=C(CCc(c2)cccc2)c(c1)cccc1 | + | SMILES O=C(CCc(c2)cccc2)c(c1)cccc1 |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
16 17 0 0 0 0 0 0 0 0999 V2000
-2.1962 0.6388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1962 -0.0009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6422 -0.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0882 -0.0009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0882 0.6388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6422 0.9586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5345 -0.3206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0180 -0.0016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5693 -0.3199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1195 -0.0023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6579 -0.3131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1962 -0.0023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1962 0.6194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6579 0.9302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1195 0.6194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5345 -0.9586 0.0000 O 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 11 2 0 0 0 0
11 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 10 1 0 0 0 0
7 16 2 0 0 0 0
S SKP 8
ID FL1D99NS0001
KNApSAcK_ID C00007921
NAME Dihydrochalcone
CAS_RN 1083-30-3
FORMULA C15H14O
EXACTMASS 210.10446507
AVERAGEMASS 210.27106000000003
SMILES O=C(CCc(c2)cccc2)c(c1)cccc1
M END
