BMFYB4CAa001

IDs and Links
LipidBank	[1]
LipidMaps	[2]
CAS	?
KEGG	C01011
KNApSAcK	{{{KNApSAcK}}}
CDX file
MOL file	BMFYB4CAa001.mol

(3S)-Citramalyl-CoA
Structural Information
Systematic Name	(3S)-Citramalyl-CoA
Common Name	(3S)-Citramalyl-CoA L-Citramalyl-CoA
Symbol
Formula	C26H42N7O20P3S
Exact Mass	897.1418
Average Mass	897.6341
SMILES	C([C@H](C(NCCC(NCCSC(C[C@](C(O)=O)(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- [ [ (2R) -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] ethanethioate (2nd)
• this ⇔ 2-Oxo-propanoic acid
• (S) -2-Hydroxy-2-methylbutanedioic acid ⇔ this
• S- [2- [3- [ [ (2R) -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] ethanethioate ⇔ this
• Succinyl-CoA ⇔ this

• EC2.8.3.11
• EC2.8.3.7
• EC4.1.3.25