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(3E)-decenoyl-CoA

MNXM164218 is deprecated and here replaced by MNXM1105996
!!! Alternative mappings exist !!!

Properties

Image

Occurences in reactions

MNX_ID

MNXM1105996

	#reac
in my sandbox	0
in MNXref (generic)	7
in models (compartimentalized)	16

formula

C₃₁H₄₈N₇O₁₇P₃S

charge

-4

mass

915.20622

reference

chebi:84793

InChIKey

CQGVNMQHZQJNII-ZJZQAHHTSA-J

InChI

InChI=1S/C31H52N7O17P3S/c1-4-5-6-7-8-9-10-11-22(40)59-15-14-33-21(39)12-13-34-29(43)26(42)31(2,3)17-52-58(49,50)55-57(47,48)51-16-20-25(54-56(44,45)46)24(41)30(53-20)38-19-37-23-27(32)35-18-36-28(23)38/h9-10,18-20,24-26,30,41-42H,4-8,11-17H2,1-3H3,(H,33,39)(H,34,43)(H,47,48)(H,49,50)(H2,32,35,36)(H2,44,45,46)/p-4/b10-9+/t20-,24-,25-,26+,30-/m1/s1

SMILES

CCCCCC/C=C/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:84793 chebi:84793	(3E)-decenoyl-CoA trans-3-decenoyl-CoA(4-) trans-dec-3-enoyl-CoA(4-)
metacyc.compound:CPD-15692 metacycM:CPD-15692 seed.compound:cpd32438 seedM:cpd32438	(3E)-dec-3-enoyl-CoA 3-trans-decenoyl-CoA 3E-decenoyl-CoA trans-dec-3-enoyl-CoA
SLM:000390081 slm:000390081	(3E)-decenoyl-CoA
bigg.metabolite:dece3coa biggM:dece3coa	3-Decenoyl Coenzyme A
sabiork.compound:26402 sabiorkM:26402	trans-3-Decenoyl-CoA
hmdb:HMDB0002137	trans-3-Decenoyl-CoA (e)-S-3-Decenoate (e)-S-3-Decenoate CoA (e)-S-3-Decenoate coenzyme A (e)-S-3-Decenoic acid 3-trans-Decenoyl-CoA 3-trans-Decenoyl-coenzyme A 3-trans-decenoyl-coa S-(3E)-3-Decenoate S-(3E)-3-DecenoateCoA S-(3E)-3-Decenoatecoenzyme A S-(3E)-3-Decenoic acid trans-3-Decenoyl-coenzyme A trans-Dec-3-enoyl-coenzyme A {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-2-({[({[(3R)-3-{[2-({2-[(3E)-dec-3-enoylsulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}-3-hydroxy-2,2-dimethylpropoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]oxy}methyl)-4-hydroxyoxolan-3-yl]oxy}phosphonic acid
lipidmaps:LMFA07050386 lipidmapsM:LMFA07050386	trans-3-Decenoyl-CoA CoA 10:1 {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-2-({[({[(3R)-3-{[2-({2-[(3E)-dec-3-enoylsulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}-3-hydroxy-2,2-dimethylpropoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]oxy}methyl)-4-hydroxyoxolan-3-yl]oxy}phosphonic acid
reactome:R-ALL-109994 reactomeM:R-ALL-109994 CHEBI:29126 chebi:29126	trans-dec-3-enoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(3E)-dec-3-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3-trans-decenoyl-CoA 3-trans-decenoyl-coenzyme A trans-3-decenoyl-CoA trans-3-decenoyl-coenzyme A trans-dec-3-enoyl-coenzyme A
hmdb:HMDB02137 biggM:M_dece3coa seedM:M_cpd32438	secondary/obsolete/fantasy identifier