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(3S)-hydroxyhexadecanoyl-CoA

Properties
MNX_IDMNXM825
formulaC37H62N7O18P3S
charge-4
mass1017.911843
referencechebi:62613
Image of MNXM825
InChIKeyDEHLMTDDPWDRDR-BCIKBWLNSA-J
InChIInChI=1S/C37H66N7O18P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-25(45)20-28(47)66-19-18-39-27(46)16-17-40-35(50)32(49)37(2,3)22-59-65(56,57)62-64(54,55)58-21-26-31(61-63(51,52)53)30(48)36(60-26)44-24-43-29-33(38)41-23-42-34(29)44/h23-26,30-32,36,45,48-49H,4-22H2,1-3H3,(H,39,46)(H,40,50)(H,54,55)(H,56,57)(H2,38,41,42)(H2,51,52,53)/p-4/t25-,26+,30+,31+,32-,36+/m0/s1
SMILESCCCCCCCCCCCCC[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]([C@H](O)[C@@H]1OP([O-])([O-])=O)n1cnc2c(N)ncnc12

Occurences in reactions

#reac
Distinct reactions in my sandbox 0
Distinct generic reactions in MNXref6
Distinct compatimentalized reactions in models12

Similar chemical compounds in external resources
IdentifierDescription
seedM:cpd03113 (S)-3-Hydroxyhexadecanoyl-CoA
(S)-3-hydroxyhexadecanoyl-CoA
(S)-3-hydroxypalmitoyl-CoA
3S-hydroxyhexadecanoyl-AoA
3hhdcoa
biggM:3hexdcoa 3-hydroxyhexadecanoylcoa
hmdb:HMDB0003932 (S)-3-Hydroxyhexadecanoyl-CoA
(S)-3-Hydroxyhexadecanoyl-coenzyme A
(S)-3-Hydroxypalmitoyl-coenzyme A
3-Hydroxyhexadecanoyl-CoA
3-Hydroxyhexadecanoyl-coenzyme A
DL-3-Hydroxyhexadecanoyl-S-coenzyme A
DL-3-Hydroxyhexadecanoyl-Scoenzyme A
DL-3-Hydroxyhexadecanoyl-scoa
S-(3-Hydroxyhexadecanoate
S-(3-Hydroxyhexadecanoate)coenzyme A
S-(3-Hydroxyhexadecanoic acid
S-DL-3-Hydroxyhexadecanoate
S-DL-3-Hydroxyhexadecanoic acid
[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[({hydroxy[hydroxy(3-hydroxy-3-({2-[(2-{[(3S)-3-hydroxyhexadecanoyl]sulfanyl}ethyl)carbamoyl]ethyl}carbamoyl)-2,2-dimethylpropoxy)phosphoryl]oxyphosphoryl}oxy)methyl]oxolan-3-yl]oxyphosphonic acid
b-Hydroxypalmitoyl-CoA
b-Hydroxypalmitoyl-coenzyme A
beta-Hydroxypalmitoyl-CoA
beta-Hydroxypalmitoyl-coenzyme A
{[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[3-hydroxy-3-({2-[(2-{[(3S)-3-hydroxyhexadecanoyl]sulfanyl}ethyl)carbamoyl]ethyl}carbamoyl)-2,2-dimethylpropoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid
chebi:62613 (3S)-hydroxyhexadecanoyl-CoA
(S)-3-hydroxypalmitoyl-CoA(4-)
(SS)-3-hydroxyhexadecanoyl-CoA(4-)
3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxyhexadecanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] diphosphate}
biggM:M_3hexdcoa
biggM:M_3hhdcoa
biggM:M_HC01397
chebi:18752
chebi:397
hmdb:HMDB03932
keggC:M_C05258
seedM:M_cpd03113
secondary/obsolete/fantasy identifier
chebi:27402
reactome:R-ALL-77300
(S)-3-hydroxypalmitoyl-CoA
(S)-3-Hydroxyhexadecanoyl-CoA
(S)-3-hydroxyhexadecanoyl-coenzyme A
(S)-3-hydroxypalmitoyl-coenzyme A
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxyhexadecanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
lipidmaps:LMFA07050161 (S)-3-hydroxypalmitoyl-CoA
(S)-3-hydroxyhexadecanoyl-coenzyme A
(S)-3-hydroxypalmitoyl-coenzyme A
3S-hydroxyhexadecanoyl-CoA
CoA(16:0(OH))
metacycM:CPD0-2232 (S)-3-hydroxyhexadecanoyl-CoA
(S)-3-hydroxypalmitoyl-CoA
3S-hydroxyhexadecanoyl-AoA
biggM:HC01397 3S-Hydroxyhexadecanoyl Coenzyme A
slm:000000868 (3S)-hydroxyhexadecanoyl-CoA
biggM:3hhdcoa
keggC:C05258
sabiorkM:2735
(S)-3-Hydroxyhexadecanoyl-CoA
MNXM163183is deprecated and replaced by this entry
MNXM31742is deprecated and replaced by this entry
MNXM90043is deprecated and replaced by this entry
MNXM91799is deprecated and replaced by this entry