Mol:FL4DALNI0010
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 37 39 0 0 0 0 0 0 0 0999 V2000 | + | 37 39 0 0 0 0 0 0 0 0999 V2000 |
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| − | 16 22 1 0 0 0 0 | + | 16 22 1 0 0 0 0 |
| − | 15 23 1 0 0 0 0 | + | 15 23 1 0 0 0 0 |
| − | 23 24 1 0 0 0 0 | + | 23 24 1 0 0 0 0 |
| − | 24 25 2 0 0 0 0 | + | 24 25 2 0 0 0 0 |
| − | 25 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
| − | 25 27 1 0 0 0 0 | + | 25 27 1 0 0 0 0 |
| − | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
| − | 28 29 1 0 0 0 0 | + | 28 29 1 0 0 0 0 |
| − | 29 30 2 0 0 0 0 | + | 29 30 2 0 0 0 0 |
| − | 30 31 1 0 0 0 0 | + | 30 31 1 0 0 0 0 |
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| − | 35 36 1 0 0 0 0 | + | 35 36 1 0 0 0 0 |
| − | 35 37 1 0 0 0 0 | + | 35 37 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL4DALNI0010 | + | ID FL4DALNI0010 |
| − | KNApSAcK_ID C00014387 | + | KNApSAcK_ID C00014387 |
| − | NAME Sanggenol D;3,5,7,2',4'-Pentahydroxy-5'-prenyl-3'-geranylflavanone | + | NAME Sanggenol D;3,5,7,2',4'-Pentahydroxy-5'-prenyl-3'-geranylflavanone |
| − | CAS_RN 174423-33-7 | + | CAS_RN 174423-33-7 |
| − | FORMULA C30H36O7 | + | FORMULA C30H36O7 |
| − | EXACTMASS 508.246103506 | + | EXACTMASS 508.246103506 |
| − | AVERAGEMASS 508.60264000000006 | + | AVERAGEMASS 508.60264000000006 |
| − | SMILES C(CCC=C(C)C)(=CCc(c3O)c(c(cc3CC=C(C)C)C(O2)C(O)C(=O)c(c12)c(O)cc(c1)O)O)C | + | SMILES C(CCC=C(C)C)(=CCc(c3O)c(c(cc3CC=C(C)C)C(O2)C(O)C(=O)c(c12)c(O)cc(c1)O)O)C |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
37 39 0 0 0 0 0 0 0 0999 V2000
-5.0276 -0.8498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3075 -0.4436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.0363 -1.6728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3235 -2.0936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6079 -1.6908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5967 -0.8659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8948 -2.1131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1768 -1.7064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1700 -0.8817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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-1.4481 -0.4822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4392 0.3434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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-0.7381 -0.9010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9098 -2.9380 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.3384 -2.9185 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
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0.7279 -0.9238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4374 -0.5142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1518 -0.9267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1518 -1.7217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8906 -0.5001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5502 -0.8809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3272 -0.4323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0545 -0.8522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0545 -1.5740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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25 27 1 0 0 0 0
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30 31 1 0 0 0 0
30 32 1 0 0 0 0
13 33 1 0 0 0 0
33 34 1 0 0 0 0
34 35 2 0 0 0 0
35 36 1 0 0 0 0
35 37 1 0 0 0 0
S SKP 8
ID FL4DALNI0010
KNApSAcK_ID C00014387
NAME Sanggenol D;3,5,7,2',4'-Pentahydroxy-5'-prenyl-3'-geranylflavanone
CAS_RN 174423-33-7
FORMULA C30H36O7
EXACTMASS 508.246103506
AVERAGEMASS 508.60264000000006
SMILES C(CCC=C(C)C)(=CCc(c3O)c(c(cc3CC=C(C)C)C(O2)C(O)C(=O)c(c12)c(O)cc(c1)O)O)C
M END
