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(3R)-3-hydroxydecanoyl-CoA

Properties

Image

Occurences in reactions

MNX_ID

MNXM9497

	#reac
in my sandbox	0
in MNXref (generic)	6
in models (compartimentalized)	2

formula

C₃₁H₅₀N₇O₁₈P₃S

charge

-4

mass

933.21678

reference

chebi:74272

InChIKey

HIVSMYZAMUNFKZ-PDQACDDGSA-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-/m1/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:74272 chebi:74272	(3R)-3-hydroxydecanoyl-CoA (R)-3-hydroxydecanoyl-CoA (R)-3-hydroxydecanoyl-CoA(4-) (R)-3-hydroxydecanoyl-coenzyme A(4-) 3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3R)-3-hydroxydecanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] diphosphate}
sabiork.compound:23708 sabiorkM:23708	(3R)-Hydroxydecanoyl-CoA (R)-3-Hydroxydecanoyl-CoA Adenosine, 5'-O-[hydroxy[[hydroxy[(3R)-3-hydroxy-4-[[3-[[2-[[(3R)-3-hydroxy-1-oxodecyl]thio]ethyl]amino]-3-oxopropyl]amino]-2,2-dimethyl-4-oxobutoxy]phosphinyl]oxy]phosphinyl]-, 3'-(dihydrogen phospha te), ion(4-)
metacyc.compound:CPD-12777 metacycM:CPD-12777 SLM:000485319 slm:000485319	(3R)-hydroxydecanoyl-CoA
seed.compound:cpd23572 seedM:cpd23572	(R)-3-hydroxydecanoyl-CoA (3R)-hydroxydecanoyl-CoA
CHEBI:74405 chebi:74405	(R)-3-hydroxydecanoyl-CoA (R)-3-hydroxydecanoyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3R)-3-hydroxydecanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
seedM:M_cpd23572	secondary/obsolete/fantasy identifier