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2-hydroxycyclohexane-1-carbonyl-CoA

MNXM5472 is deprecated and here replaced by MNXM738006
!!! Alternative mappings exist !!!
PropertiesImageOccurences in reactions
MNX_IDMNXM738006Image of MNXM738006
#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
formulaC28H46N7O18P3S
charge0
mass893.18329
referencechebi:28169
InChIKeyOIFANTIHESWSAR-AZKLLKNGSA-N
InChIInChI=1S/C28H46N7O18P3S/c1-28(2,22(39)25(40)31-8-7-18(37)30-9-10-57-27(41)15-5-3-4-6-16(15)36)12-50-56(47,48)53-55(45,46)49-11-17-21(52-54(42,43)44)20(38)26(51-17)35-14-34-19-23(29)32-13-33-24(19)35/h13-17,20-22,26,36,38-39H,3-12H2,1-2H3,(H,30,37)(H,31,40)(H,45,46)(H,47,48)(H2,29,32,33)(H2,42,43,44)/t15?,16?,17-,20-,21-,22+,26-/m1/s1
SMILESCC(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)[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)C1CCCCC1O
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:28169
chebi:28169 		2-hydroxycyclohexane-1-carbonyl-CoA
2-Hydroxycyclohexane-1-carbonyl-CoA
2-Hydroxycyclohexane-1-carboxyl-CoA
2-Hydroxycyclohexanecarbonyl-CoA
2-Hydroxycyclohexanecarboxyl-CoA
2-hydroxycyclohexane-1-carbonyl-coenzyme A
2-hydroxycyclohexanecarboxyl-coenzyme A
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(2-hydroxycyclohexane-1-carbonyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
kegg.compound:C09812
keggC:C09812 		2-Hydroxycyclohexane-1-carboxyl-CoA
seed.compound:cpd06704
seedM:cpd06704 		2-Hydroxycyclohexane-1-carboxyl-CoA
2-hydroxy-cyclohexane-1-carbonyl-CoA
2-hydroxy-cyclohexane-1-carboxyl-CoA
metacyc.compound:CPD-537
metacycM:CPD-537 		2-hydroxy-cyclohexane-1-carbonyl-CoA
2-hydroxy-cyclohexane-1-carboxyl-CoA
lipidmaps:LMFA07050182
lipidmapsM:LMFA07050182 		2-hydroxycyclohexane-1-carbonyl-CoA
2-Hydroxycyclohexane-1-carbonyl-CoA
2-Hydroxycyclohexanecarbonyl-CoA
2-Hydroxycyclohexanecarboxyl-CoA
2-hydroxycyclohexane-1-carbonyl-coenzyme A
2-hydroxycyclohexanecarboxyl-coenzyme A
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(2-hydroxycyclohexane-1-carbonyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
CoA 7:1
O
chebi:1153
chebi:19635
keggC:M_C09812
seedM:M_cpd06704 		secondary/obsolete/fantasy identifier