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(3S)-hydroxydecanoyl-CoA

MNXM674 is deprecated and here replaced by MNXM1104681
!!! Alternative mappings exist !!!

Properties

Image

Occurences in reactions

MNX_ID

MNXM1104681

	#reac
in my sandbox	0
in MNXref (generic)	7
in models (compartimentalized)	12

formula

C₃₁H₅₀N₇O₁₈P₃S

charge

-4

mass

933.21678

reference

chebi:62616

InChIKey

HIVSMYZAMUNFKZ-PNPVFPMQSA-J

InChI

InChI=1S/C31H54N7O18P3S/c1-4-5-6-7-8-9-19(39)14-22(41)60-13-12-33-21(40)10-11-34-29(44)26(43)31(2,3)16-53-59(50,51)56-58(48,49)52-15-20-25(55-57(45,46)47)24(42)30(54-20)38-18-37-23-27(32)35-17-36-28(23)38/h17-20,24-26,30,39,42-43H,4-16H2,1-3H3,(H,33,40)(H,34,44)(H,48,49)(H,50,51)(H2,32,35,36)(H2,45,46,47)/p-4/t19-,20+,24+,25+,26-,30+/m0/s1

SMILES

CCCCCCC[C@H](O)CC(=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:62616 chebi:62616	(3S)-hydroxydecanoyl-CoA (S)-3-hydroxydecanoyl-CoA(4-) 3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxydecanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] diphosphate}
SLM:000001027 slm:000001027	(3S)-hydroxydecanoyl-CoA
bigg.metabolite:3hdcoa biggM:3hdcoa	(S)-3-Hydroxydecanoyl-CoA
sabiork.compound:2741 sabiorkM:2741	(S)-3-Hydroxydecanoyl-CoA (S)-Hydroxydecanoyl-CoA
metacyc.compound:CPD0-2244 metacycM:CPD0-2244	(S)-3-hydroxydecanoyl-CoA
reactome:R-ALL-77341 reactomeM:R-ALL-77341 CHEBI:28325 chebi:28325	(S)-3-hydroxydecanoyl-CoA (S)-3-Hydroxydecanoyl-CoA (S)-3-hydroxydecanoyl-coenzyme A (S)-Hydroxydecanoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxydecanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3-Hydroxydecanoyl-coenzyme A 3-OH 10:0-CoA 3-OH C10:0-CoA S-(3-hydroxydecanoyl)coenzyme A beta-hydroxydecanoyl coenzyme A beta-hydroxydecanoyl-CoA coenzyme A S-3-hydroxydecanoate
kegg.compound:C05264 keggC:C05264	(S)-Hydroxydecanoyl-CoA (S)-3-Hydroxydecanoyl-CoA
seed.compound:cpd03118 seedM:cpd03118	(S)-Hydroxydecanoyl-CoA (S)-3-Hydroxydecanoyl-CoA (S)-3-hydroxydecanoyl-CoA 3hdccoa
chebi:18779 chebi:418 biggM:M_3hdcoa keggC:M_C05264 seedM:M_cpd03118	secondary/obsolete/fantasy identifier