BMFYS6ESa001
From Metabolomics.JP
Basic Metabolism Top (代謝トップ) |
Molecule Index (化合物索引) |
EC classes ( EC分類) |
Input New Data (新規入力) |
Upper classes : BM Basic Metabolites : BMFY Fatty acyl 脂肪酸 : BMFYS straight chain 鎖状 (290 pages)
IDs and Links | |
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LipidBank | [1] |
LipidMaps | [2] |
CAS | 79171-47-4 |
KEGG | C05268 |
KNApSAcK | |
CDX file | |
MOL file | BMFYS6ESa001.mol |
(S) -Hydroxyhexanoyl-CoA | |
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Structural Information | |
Systematic Name | S- [2- [3- [ [4- [ [ [(2R,3S,4R,5R) -5- (6-Aminopurin-9-yl) -4-hydroxy-3-phosphonooxyoxolan-2-yl] methoxy-hydroxyphosphoryl] oxy-hydroxyphosphoryl] oxy-2-hydroxy-3,3-dimethylbutanoyl] amino] propanoylamino] ethyl] (3S) -3-hydroxyhexanethioic acid |
Common Name |
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Symbol | |
Formula | C27H46N7O18P3S |
Exact Mass | 881.1832 |
Average Mass | 881.6778 |
SMILES | C([C@H](C(NCCC(NCCSC(C[C@H](CCC)O)=O)=O)=O)O)(C)(C |
Physicochemical Information | |
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Optical Rotation | |
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Spectral Information | |
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Related Atomic Mappings, Enzymes, and Pathways