Feedback

docosanoyl-CoA

MNXM726560 is deprecated and replaced by MNXM726559

Properties

Image

Occurences in reactions

MNX_ID

MNXM726559

	#reac
in my sandbox	0
in MNXref (generic)	23
in models (compartimentalized)	48

formula

C₄₃H₇₄N₇O₁₇P₃S

charge

-4

mass

1085.40967

reference

chebi:65059

InChIKey

NDDZLVOCGALPLR-GNSUAQHMSA-J

InChI

InChI=1S/C43H78N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-34(52)71-27-26-45-33(51)24-25-46-41(55)38(54)43(2,3)29-64-70(61,62)67-69(59,60)63-28-32-37(66-68(56,57)58)36(53)42(65-32)50-31-49-35-39(44)47-30-48-40(35)50/h30-32,36-38,42,53-54H,4-29H2,1-3H3,(H,45,51)(H,46,55)(H,59,60)(H,61,62)(H2,44,47,48)(H2,56,57,58)/p-4/t32-,36-,37-,38+,42-/m1/s1

SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)([O-])OP(=O)([O-])OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)([O-])[O-]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:65059 chebi:65059	docosanoyl-CoA behenoyl-CoA(4-) behenoyl-coenzyme A(4-) docosanoyl-CoA(4-) docosanoyl-coenzyme A(4-)
sabiork.compound:20020 sabiorkM:20020	Behenoyl-CoA
lipidmaps:LMFA07050289 lipidmapsM:LMFA07050289	Behenoyl-CoA Behenyl-coenzyme A CoA 22:0 Docosanoyl-CoA behenoyl-coenzyme A behenyl CoA docosanoyl-coenzyme A
seed.compound:cpd16343 seedM:cpd16343	Behenoyl-CoA Docosanoyl-CoA behenoyl CoA docosanoyl-CoA
bigg.metabolite:docoscoa biggM:docoscoa	Docosanoyl Coenzyme A
kegg.compound:C16528 keggC:C16528	Docosanoyl-CoA Behenoyl-CoA
SLM:000000587 slm:000000587	docosanoyl-CoA
CHEBI:65088 chebi:65088	docosanoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-({2-[(docosanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}butyl] dihydrogen diphosphate} Behenyl-coenzyme A behenoyl-CoA behenoyl-coenzyme A behenyl CoA docosanoyl-coenzyme A
metacyc.compound:CPD-10279 metacycM:CPD-10279	docosanoyl-CoA behenoyl-CoA
biggM:M_docoscoa keggC:M_C16528 seedM:M_cpd16343	secondary/obsolete/fantasy identifier