coenzyme B
Chemical Formula:
C11H19NO7PS
Molecular Weight:
340.307 Daltons
Monoisotopic Mass:
343.0854592661 Daltons
SMILES:
CC(OP([O-])(=O)[O-])C(NC(CCCCCCS)=O)C(=O)[O-]
InChI:
1S/C11H22NO7PS/c1-8(19-20(16,17)18)10(11(14)15)12-9(13)6-4-2-3-5-7-21/h8,10,21H,2-7H2,1H3,(H,12,13)(H,14,15)(H2,16,17,18)/p-3/t8-,10+/m1/s1
InChIKey:
Synonyms
- N-(7-mercaptoheptanoyl)-3-O-phosphono-L-threonine
- N-(7-mercaptoheptanoyl)threonine 3-O-phosphate
- CoB
- H-S-CoB
- 7-mercaptoheptanoyl threonine phosphate
- HS-HTP
- N-(7-mercaptoheptanoyl)-L-threonine 3-O-phosphate
- N-(7-mercaptoheptanoyl)-3-phospho-L-threonine
- N-(7-sulfanylheptanoyl)-L-threonine 3-O-phosphate
- N-(7-sulfanylheptanoyl)-3-O-phosphono-L-threonine
- N-(7-sulfanylheptanoyl)-3-phospho-L-threonine
- N-(7-mercaptoheptanoyl)threonine O3-phosphate
- HTP
Databases
MetaCyc:
CPD-1281
RefMet:
Coenzyme B
KEGG:
C04628
Seed:
cpd02817
MetaNetX:
MNXM921
PupChem (SID):
7217
KNApSAcK:
C00000760
PDB-CCD:
TP7
NIKKAJI:
J372.864A