BMFYB4HOa001

IDs and Links
LipidBank	[1]
LipidMaps	[2]
CAS	?
KEGG	C05997
KNApSAcK	{{{KNApSAcK}}}
CDX file
MOL file	BMFYB4HOa001.mol

3-Hydroxyisopentyl-CoA
Structural Information
Systematic Name	3-Hydroxy-isopentyl-CoA
Common Name	3-Hydroxyisopentyl-CoA 3-Hydroxyisopentyl coenzyme A
Symbol
Formula	C26H44N7O18P3S
Exact Mass	867.1676
Average Mass	867.6512
SMILES	C([C@H](C(NCCC(NCCSC(CC(C)(C)O)=O)=O)=O)O)(C)(C)COP(OP(OC[C@H]([C@@H](OP(O)(O)=O)3)O[C@H]([C@@H]3O)n(c21)cnc(c(N)ncn2)1)(O)=O)(O)=O
Physicochemical Information
Melting Point
Boiling Point
Density
Optical Rotation
Reflactive Index
Solubility
Spectral Information
Mass Spectra
UV Spectra
IR Spectra
NMR Spectra
Chromatograms

Related Atomic Mappings, Enzymes, and Pathways

• this ⇔ 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] 3-methylbut-2-enethioic acid

• EC4.2.1.17