BMMCBZ2Pa022

IDs and Links
LipidBank	[1]
LipidMaps	[2]
CAS	27718-41-8
KEGG	C02949
KNApSAcK	{{{KNApSAcK}}}
CDX file
MOL file	BMMCBZ2Pa022.mol

Structural Information
Systematic Name	4-Hydroxy-benzoyl-CoA
Common Name
Symbol
Formula	C28H40N7O18P3S
Exact Mass	887.1363
Average Mass	887.6408
SMILES	c(c4)c(ccc4O)C(SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(OP(OC[C@H]([C@@H](OP(O)(O)=O)1)O[C@@H](n(c23)cnc2c(ncn3)N)[C@@H]1O)(O)=O)(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

• Benzoyl-CoA ⇔ this
• 4-Chloro-benzoyl-CoA ⇔ this
• this ⇔ CoA
• this ⇔ 4-Coumaroyl-CoA
• this ⇔ 4-Hydroxybenzoic acid

• EC3.1.2.23
• EC3.8.1.7
• EC6.2.1.27

• P-hydroxybenzoate_biosynthesis
• P-hydroxybenzoate_biosynthesis