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(3S)-3-hydroxybutanoyl-CoA

PropertiesImageOccurences in reactions
MNX_IDMNXM1105912Image of MNXM1105912
#reac
in my sandbox 0
in MNXref (generic)12
in models (compartimentalized) 15
formulaC25H38N7O18P3S
charge-4
mass849.12288
referencechebi:57316
InChIKeyQHHKKMYHDBRONY-VKBDFPRVSA-J
InChIInChI=1S/C25H42N7O18P3S/c1-13(33)8-16(35)54-7-6-27-15(34)4-5-28-23(38)20(37)25(2,3)10-47-53(44,45)50-52(42,43)46-9-14-19(49-51(39,40)41)18(36)24(48-14)32-12-31-17-21(26)29-11-30-22(17)32/h11-14,18-20,24,33,36-37H,4-10H2,1-3H3,(H,27,34)(H,28,38)(H,42,43)(H,44,45)(H2,26,29,30)(H2,39,40,41)/p-4/t13-,14+,18+,19+,20-,24+/m0/s1
SMILESC[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
IdentifierDescription
CHEBI:57316
chebi:57316 		(3S)-3-hydroxybutanoyl-CoA
(S)-3-hydroxybutanoyl-CoA(4-)
3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxybutanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] diphosphate}
envipath:...b6c15d72ad5e
envipathM:...b6c15d72ad5e 		(3S)-3-Hydroxybutyryl-CoA
SLM:000001032
slm:000001032 		(3S)-hydroxybutanoyl-CoA
bigg.metabolite:3hbcoa
biggM:3hbcoa 		(S)-3-Hydroxybutanoyl-CoA
sabiork.compound:2254
sabiorkM:2254
kegg.compound:C01144
keggC:C01144 		(S)-3-Hydroxybutanoyl-CoA
(S)-3-Hydroxybutyryl-CoA
seed.compound:cpd00842
seedM:cpd00842 		(S)-3-Hydroxybutyryl-CoA
(S)-3-Hydroxybutanoyl-CoA
(S)-3-hydroxybutanoyl-CoA
3hbycoa
L-3-hydroxybutyryl-CoA
reactome:R-ALL-77251
reactomeM:R-ALL-77251
CHEBI:15453
chebi:15453 		(S)-3-hydroxybutanoyl-CoA
(3S)-3-hydroxybutanoyl-CoA
(S)-3-Hydroxybutanoyl-CoA
(S)-3-Hydroxybutyryl-CoA
(S)-3-hydroxybutyroyl-CoA
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxybutanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
L(+)-3-hydroxybutyroyl-CoA
L(+)-beta-hydroxybutyroyl-CoA
L-3-hydroxybutanoyl-CoA
lipidmaps:LMFA07050153
lipidmapsM:LMFA07050153 		(S)-3-hydroxybutanoyl-CoA
(3S)-3-hydroxybutanoyl-CoA
(S)-3-hydroxybutyroyl-CoA
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxybutanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
CoA 4:0
L(+)-3-hydroxybutyroyl-CoA
L(+)-beta-hydroxybutyroyl-CoA
L-3-hydroxybutanoyl-CoA
O
metacyc.compound:S-3-HYDROXYBUTANOYL-COA
metacycM:S-3-HYDROXYBUTANOYL-COA 		(S)-3-hydroxybutanoyl-CoA
L-3-hydroxybutyryl-CoA
chebi:11048
chebi:18749
chebi:394
chebi:39978
biggM:M_3hbcoa
keggC:M_C01144
seedM:M_cpd00842 		secondary/obsolete/fantasy identifier