MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

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juvenile hormone III

	Properties	Image
MNX_ID	MNXM2685
reference	chebi:27493
formula	C₁₆H₂₆O₃
global charge	0
mol weight	266.381
InChIKey	QVJMXSGZTCGLHZ-HONBPKQLSA-N
InChI	InChI=1S/C16H26O3/c1-12(9-10-14-16(3,4)19-14)7-6-8-13(2)11-15(17)18-5/h7,11,14H,6,8-10H2,1-5H3/b12-7+,13-11+/t14-/m1/s1
SMILES	COC(=O)/C=C(\C)CC/C=C(\C)CC[C@H]1OC1(C)C

MNX internals

InChI (mnx)	InChI=1/C16H26O3/c1-12(9-10-14-16(3,4)19-14)7-6-8-13(2)11-15(17)18-5/h7,11,14H,6,8-10H2,1-5H3/b12-7+,13-11+/t14-/m1/s1
SMILES (mnx)	[CH3:1]/[C:12](=[CH:7]\[CH2:6][CH2:8]/[C:13]([CH3:2])=[CH:11]/[C:15](=[O:17])[O:18][CH3:5])[CH2:9][CH2:10][C@@H:14]1[C:16]([CH3:3])([CH3:4])[O:19]1

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	9
in models (compartimentalized)	1

Similar chemical compounds in external resources
Identifier	Description
CHEBI:27493 chebi:27493 QVJMXSGZTCGLHZ-HONBPKQLSA-N	juvenile hormone III (+)-Juvenile hormone III (10R)-Juvenile hormone III JH III Juvenile hormone 3 Methyl (2E,6E)-(10R)-10,11-epoxy-3,7,11-trimethyl-2,6-dodecadienoate Methyl (R-(E,E))-9-(3,3-dimethyloxiranyl)-3,7-dimethyl-2,6-nonadienoate Methyl 10,11-epoxy-3,7,11-trimethyl-trans,trans-(10R)-2,6-dodecadienoate Methyl 10,11-epoxy-3,7,11-trimethyl-trans,trans-2,6-dodecadienoate Methyl R-(+)-10,11-epoxyfarnesate methyl (2E,6E)-9-[(2R)-3,3-dimethyloxiran-2-yl]-3,7-dimethylnona-2,6-dienoate
kegg.compound:C09694 keggC:C09694 lipidmaps:LMPR0103010004 lipidmapsM:LMPR0103010004 vmhM:jh3 vmhmetabolite:jh3 QVJMXSGZTCGLHZ-HONBPKQLSA-N	Juvenile hormone III
seed.compound:cpd06588 seedM:cpd06588 QVJMXSGZTCGLHZ-HONBPKQLSA-N	Juvenile hormone III JH III juvenile hormone III methyl (2E,6E)-(10R)-10,11-epoxy-3,7,11-trimethyl-2,6-dodecadienoate methyl (2E,6E,10R)-10,11-epoxy-3,7,11-trimethyl-2,6-dodecadienoate
metacyc.compound:CPD-8838 metacycM:CPD-8838 QVJMXSGZTCGLHZ-HONBPKQLSA-N	juvenile hormone III JH III methyl (2E,6E,10R)-10,11-epoxy-3,7,11-trimethyl-2,6-dodecadienoate
chebi:24940 chebi:6096 keggC:M_C09694 seedM:M_cpd06588 vmhM:M_jh3	secondary/obsolete/fantasy identifier