Mol:FL2FALNI0033
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 32 34 0 0 0 0 0 0 0 0999 V2000 | + | 32 34 0 0 0 0 0 0 0 0999 V2000 |
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| − | 14 15 1 0 0 0 0 | + | 14 15 1 0 0 0 0 |
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| − | 3 19 1 0 0 0 0 | + | 3 19 1 0 0 0 0 |
| − | 14 20 1 0 0 0 0 | + | 14 20 1 0 0 0 0 |
| − | 15 21 1 0 0 0 0 | + | 15 21 1 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
| − | 21 23 1 0 0 0 0 | + | 21 23 1 0 0 0 0 |
| − | 21 24 1 0 0 0 0 | + | 21 24 1 0 0 0 0 |
| − | 24 25 2 0 0 0 0 | + | 24 25 2 0 0 0 0 |
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| − | 28 29 1 0 0 0 0 | + | 28 29 1 0 0 0 0 |
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| − | 12 31 1 0 0 0 0 | + | 12 31 1 0 0 0 0 |
| − | 31 32 1 0 0 0 0 | + | 31 32 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FALNI0033 | + | ID FL2FALNI0033 |
| − | KNApSAcK_ID C00014184 | + | KNApSAcK_ID C00014184 |
| − | NAME (2S)-5,7,4'-Trihydroxy-2'-methoxy-8-prenyl-5'-(1,1-dimethylallyl)flavanone | + | NAME (2S)-5,7,4'-Trihydroxy-2'-methoxy-8-prenyl-5'-(1,1-dimethylallyl)flavanone |
| − | CAS_RN 460345-18-0 | + | CAS_RN 460345-18-0 |
| − | FORMULA C26H30O6 | + | FORMULA C26H30O6 |
| − | EXACTMASS 438.204238692 | + | EXACTMASS 438.204238692 |
| − | AVERAGEMASS 438.51279999999997 | + | AVERAGEMASS 438.51279999999997 |
| − | SMILES C(C=C(C)C)c(c3O)c(O1)c(c(O)c3)C(=O)CC(c(c2)c(OC)cc(c2C(C=C)(C)C)O)1 | + | SMILES C(C=C(C)C)c(c3O)c(O1)c(c(O)c3)C(=O)CC(c(c2)c(OC)cc(c2C(C=C)(C)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/
32 34 0 0 0 0 0 0 0 0999 V2000
-2.4974 -0.8257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4788 -1.6296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7017 -2.0148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0468 -1.6137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0327 -0.7888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7583 -0.3638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2919 -2.0392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3819 -1.6382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3727 -0.7719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3112 -0.3886 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0872 -0.3594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7782 -0.7459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4896 -0.3474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5101 0.4774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7983 0.9072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0779 0.5070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2919 -2.8641 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2119 -0.4132 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7017 -2.8393 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2119 0.8826 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7983 1.6091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9718 2.2566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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-3.1873 1.9883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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1.7782 -1.4460 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4174 -1.8150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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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
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12 13 1 0 0 0 0
13 14 2 0 0 0 0
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7 17 2 0 0 0 0
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3 19 1 0 0 0 0
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15 21 1 0 0 0 0
21 22 1 0 0 0 0
21 23 1 0 0 0 0
21 24 1 0 0 0 0
24 25 2 0 0 0 0
6 26 1 0 0 0 0
26 27 1 0 0 0 0
27 28 2 0 0 0 0
28 29 1 0 0 0 0
28 30 1 0 0 0 0
12 31 1 0 0 0 0
31 32 1 0 0 0 0
S SKP 8
ID FL2FALNI0033
KNApSAcK_ID C00014184
NAME (2S)-5,7,4'-Trihydroxy-2'-methoxy-8-prenyl-5'-(1,1-dimethylallyl)flavanone
CAS_RN 460345-18-0
FORMULA C26H30O6
EXACTMASS 438.204238692
AVERAGEMASS 438.51279999999997
SMILES C(C=C(C)C)c(c3O)c(O1)c(c(O)c3)C(=O)CC(c(c2)c(OC)cc(c2C(C=C)(C)C)O)1
M END
