Mol:FL2FA9NS0007
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 20 22 0 0 0 0 0 0 0 0999 V2000 | + | 20 22 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.5761 -0.7709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5761 -0.7709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0552 -1.0716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0552 -1.0716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5344 -0.7709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5344 -0.7709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5344 -0.1695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5344 -0.1695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0552 0.1313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0552 0.1313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.5761 -0.1695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5761 -0.1695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0135 -1.0716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0135 -1.0716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5074 -0.7709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5074 -0.7709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5074 -0.1695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5074 -0.1695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0135 0.1313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0135 0.1313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0278 0.1310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0278 0.1310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0135 -1.5956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0135 -1.5956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5621 -0.1775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5621 -0.1775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0965 0.1310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0965 0.1310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0965 0.7480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0965 0.7480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5621 1.0565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5621 1.0565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0278 0.7480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0278 0.7480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0552 -1.6725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0552 -1.6725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0965 0.1310 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0965 0.1310 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5621 1.6725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5621 1.6725 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 |
| − | 3 7 1 0 0 0 0 | + | 3 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 4 1 0 0 0 0 | + | 10 4 1 0 0 0 0 |
| − | 9 11 1 0 0 0 0 | + | 9 11 1 0 0 0 0 |
| − | 7 12 2 0 0 0 0 | + | 7 12 2 0 0 0 0 |
| − | 11 13 2 0 0 0 0 | + | 11 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 11 1 0 0 0 0 | + | 17 11 1 0 0 0 0 |
| − | 2 18 1 0 0 0 0 | + | 2 18 1 0 0 0 0 |
| − | 6 19 1 0 0 0 0 | + | 6 19 1 0 0 0 0 |
| − | 16 20 1 0 0 0 0 | + | 16 20 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FA9NS0007 | + | ID FL2FA9NS0007 |
| − | KNApSAcK_ID C00008479 | + | KNApSAcK_ID C00008479 |
| − | NAME 5,7,3'-Trihydroxyflavanone | + | NAME 5,7,3'-Trihydroxyflavanone |
| − | CAS_RN 104732-07-2 | + | CAS_RN 104732-07-2 |
| − | FORMULA C15H12O5 | + | FORMULA C15H12O5 |
| − | EXACTMASS 272.068473494 | + | EXACTMASS 272.068473494 |
| − | AVERAGEMASS 272.25278000000003 | + | AVERAGEMASS 272.25278000000003 |
| − | SMILES Oc(c3)cc(cc3)C(C1)Oc(c2)c(c(O)cc(O)2)C(=O)1 | + | SMILES Oc(c3)cc(cc3)C(C1)Oc(c2)c(c(O)cc(O)2)C(=O)1 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
20 22 0 0 0 0 0 0 0 0999 V2000
-1.5761 -0.7709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0552 -1.0716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5344 -0.7709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5344 -0.1695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0552 0.1313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5761 -0.1695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0135 -1.0716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5074 -0.7709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5074 -0.1695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0135 0.1313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0278 0.1310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0135 -1.5956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5621 -0.1775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0965 0.1310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0965 0.7480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5621 1.0565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0278 0.7480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0552 -1.6725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.0965 0.1310 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5621 1.6725 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
3 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 4 1 0 0 0 0
9 11 1 0 0 0 0
7 12 2 0 0 0 0
11 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 11 1 0 0 0 0
2 18 1 0 0 0 0
6 19 1 0 0 0 0
16 20 1 0 0 0 0
S SKP 8
ID FL2FA9NS0007
KNApSAcK_ID C00008479
NAME 5,7,3'-Trihydroxyflavanone
CAS_RN 104732-07-2
FORMULA C15H12O5
EXACTMASS 272.068473494
AVERAGEMASS 272.25278000000003
SMILES Oc(c3)cc(cc3)C(C1)Oc(c2)c(c(O)cc(O)2)C(=O)1
M END
