Mol:BMMCIZ--S532
From Metabolomics.JP
(Difference between revisions)
(New page: Copyright: ARM project http://www.metabolome.jp/ 37 39 0 0 1 0 0 0 0 0999 V2000 7.4931 -0.5548 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1841 -1.5059 ...) |
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| Line 79: | Line 79: | ||
26 27 1 0 0 0 0 | 26 27 1 0 0 0 0 | ||
26 28 2 0 0 0 0 | 26 28 2 0 0 0 0 | ||
| − | S SKP | + | S SKP 7 |
| − | + | ||
ID BMMCIZ--S532 | ID BMMCIZ--S532 | ||
| + | NAME [(2R,3S,4R,5R) -5- [4-Carbamoyl-5- [ [(E) - [(2R,3R,4S,5R) -3,4-dihydroxy-5- (phosphonooxymethyl) oxolan-2-yl] Iminomethyl] amino] imidazol-1-yl] -3,4-dihydroxyoxolan-2-yl] methyl dihydrogen phosphate | ||
| + | CAS_RN 36244-83-4 | ||
FORMULA C15H25N5O15P2 | FORMULA C15H25N5O15P2 | ||
EXACTMASS 577.0822381749999 | EXACTMASS 577.0822381749999 | ||
AVERAGEMASS 577.331222 | AVERAGEMASS 577.331222 | ||
| + | SMILES NC(=O)c(n2)c(N=CN[C@H](O3)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)3)n(c2)[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)1 | ||
SMILES NC(=O)c(n2)c(N=CN[C@H](O3)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)3)n(c2)[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)1 | SMILES NC(=O)c(n2)c(N=CN[C@H](O3)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)3)n(c2)[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)1 | ||
M END | M END | ||
Revision as of 17:56, 17 June 2010
Copyright: ARM project http://www.metabolome.jp/
37 39 0 0 1 0 0 0 0 0999 V2000
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26 28 2 0 0 0 0
S SKP 7
ID BMMCIZ--S532
NAME [(2R,3S,4R,5R) -5- [4-Carbamoyl-5- [ [(E) - [(2R,3R,4S,5R) -3,4-dihydroxy-5- (phosphonooxymethyl) oxolan-2-yl] Iminomethyl] amino] imidazol-1-yl] -3,4-dihydroxyoxolan-2-yl] methyl dihydrogen phosphate
CAS_RN 36244-83-4
FORMULA C15H25N5O15P2
EXACTMASS 577.0822381749999
AVERAGEMASS 577.331222
SMILES NC(=O)c(n2)c(N=CN[C@H](O3)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)3)n(c2)[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)1
SMILES NC(=O)c(n2)c(N=CN[C@H](O3)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)3)n(c2)[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)1
M END
