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coenzyme B

Properties

Image

Occurences in reactions

MNX_ID

MNXM921

	#reac
in my sandbox	0
in MNXref (generic)	23
in models (compartimentalized)	13

formula

C₁₁H₁₉NO₇PS

charge

-3

mass

340.06363

reference

chebi:58596

InChIKey

JBJSVEVEEGOEBZ-SCZZXKLOSA-K

InChI

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

SMILES

C[C@@H](OP(=O)([O-])[O-])[C@H](NC(=O)CCCCCCS)C(=O)[O-]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:58596 chebi:58596	coenzyme B (2S,3R)-3-(phosphonatooxy)-2-[(7-sulfanylheptanoyl)amino]butanoate coenzyme B(3-)
kegg.compound:C04628 keggC:C04628	Coenzyme B CoB HTP N-(7-Mercaptoheptanoyl)threonine 3-O-phosphate N-(7-Mercaptoheptanoyl)threonine O3-phosphate
bigg.metabolite:cob biggM:cob	Coenzyme b
seed.compound:cpd02817 seedM:cpd02817	HTP 7-mercaptoheptanoyl threonine phosphate CoB Coenzyme B H-S-CoB HS-HTP N-(7-Mercaptoheptanoyl)threonine 3-O-phosphate N-(7-Mercaptoheptanoyl)threonine O3-phosphate N-(7-mercaptoheptanoyl)-3-O-phosphono-L-threonine N-(7-mercaptoheptanoyl)-3-phospho-L-threonine N-(7-mercaptoheptanoyl)-L-threonine 3-O-phosphate N-(7-mercaptoheptanoyl)threonine 3-O-phosphate N-(7-mercaptoheptanoyl)threonine O3-phosphate N-(7-sulfanylheptanoyl)-3-O-phosphono-L-threonine N-(7-sulfanylheptanoyl)-3-phospho-L-threonine N-(7-sulfanylheptanoyl)-L-threonine 3-O-phosphate cob coenzyme B coenzyme b
CHEBI:28890 chebi:28890	coenzyme B (2S,3R)-2-[(7-mercaptoheptanoyl)amino]-3-(phosphonooxy)butanoic acid (2S,3R)-3-phosphonooxy-2-[(7-sulfanylheptanoyl)amino]butanoic acid 7-mercaptoheptanoyl-O-phospho-L-threonine 7-mercaptoheptanoylthreonine phosphate 7-thioheptanoyl-threonine O-phosphate Coenzyme B HTP MHTP N-(7-Mercaptoheptanoyl)threonine 3-O-phosphate N-(7-Mercaptoheptanoyl)threonine O3-phosphate N-(7-mercaptoheptanoyl)-L-threonine 3-O-phosphate N-(7-sulfanylheptanoyl)-3-O-phosphono-L-threonine N-(7-sulfanylheptanoyl)-3-phospho-L-threonine N-(7-sulfanylheptanoyl)-L-threonine 3-(dihydrogen phosphate)
metacyc.compound:CPD-1281 metacycM:CPD-1281	coenzyme B 7-mercaptoheptanoyl threonine phosphate CoB H-S-CoB HS-HTP N-(7-mercaptoheptanoyl)-3-O-phosphono-L-threonine N-(7-mercaptoheptanoyl)-3-phospho-L-threonine N-(7-mercaptoheptanoyl)-L-threonine 3-O-phosphate N-(7-mercaptoheptanoyl)threonine 3-O-phosphate N-(7-mercaptoheptanoyl)threonine O3-phosphate N-(7-sulfanylheptanoyl)-3-O-phosphono-L-threonine N-(7-sulfanylheptanoyl)-3-phospho-L-threonine N-(7-sulfanylheptanoyl)-L-threonine 3-O-phosphate N-(7-sulfanylheptanoyl)threonine
chebi:12434 chebi:12534 chebi:14009 chebi:21474 chebi:23350 chebi:46031 chebi:7093 biggM:M_cob keggC:M_C04628 seedM:M_cpd02817	secondary/obsolete/fantasy identifier