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

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terpinolene

	Properties	Image
MNX_ID	MNXM4839
reference	chebi:9457
formula	C₁₀H₁₆
global charge	0
mol weight	136.238
InChIKey	MOYAFQVGZZPNRA-UHFFFAOYSA-N
InChI	InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4H,5-7H2,1-3H3
SMILES	CC1=CCC(=C(C)C)CC1

MNX internals

InChI (mnx)	InChI=1/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4H,5-7H2,1-3H3
SMILES (mnx)	[CH3:1][C:8]([CH3:2])=[C:10]1[CH2:6][CH:4]=[C:9]([CH3:3])[CH2:5][CH2:7]1

Parent-child relations graph

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

Similar chemical compounds in external resources
Identifier	Description
CHEBI:9457 chebi:9457 MOYAFQVGZZPNRA-UHFFFAOYSA-N	terpinolene 1,4(8)-p-menthadiene 1-methyl-4-(1-methylethylidene)-1-cyclohexene 1-methyl-4-(1-methylethylidene)cyclohexene 1-methyl-4-(propan-2-ylidene)cyclohexene 4-isopropylidene-1-methylcyclohexene Terpinolen Terpinolene alpha-terpinolene isoterpinene p-mentha-1,4(8)-diene
kegg.compound:C06075 keggC:C06075 MOYAFQVGZZPNRA-UHFFFAOYSA-N	Terpinolene
hmdb:HMDB0036994 MOYAFQVGZZPNRA-UHFFFAOYSA-N	Terpinolene 1,4(8)-Terpadiene 1,4(8)-p-Menthadiene 1-Methyl-4-(1-methylethylidene)-1-cyclohexene 1-Methyl-4-(1-methylethylidene)-cyclohexene 1-Methyl-4-(1-methylethylidene)cyclohexene 1-Methyl-4-(1-methylethylidene)cyclohexene, 9ci 1-Methyl-4-(propan-2-ylidene)cyclohexene 1-Methyl-4-isopropylidene-1-cyclohexene 1-methyl-4-(propan-2-ylidene)cyclohex-1-ene 4-Isopropylidene-1-methyl-cyclohexene 4-Isopropylidene-1-methylcyclohexene Cyclohexene, 3-methyl-6-(1-methylethylidene)- (9ci) FEMA 3046 Isoterpinene Terpinolen a-Terpinolene alpha -Terpinolene alpha-Terpinolene alpha-terpinolene delta-Terpinene p-Mentha-1,4(8)-diene terpinolene
seed.compound:cpd03620 seedM:cpd03620 MOYAFQVGZZPNRA-UHFFFAOYSA-N	Terpinolene terpinolene
metacyc.compound:CPD-4890 metacycM:CPD-4890 MOYAFQVGZZPNRA-UHFFFAOYSA-N	terpinolene
lipidmaps:LMPR0102090062 lipidmapsM:LMPR0102090062 MOYAFQVGZZPNRA-UHFFFAOYSA-N	terpinolene 1,4(8)-p-menthadiene 1-methyl-4-(1-methylethylidene)-1-cyclohexene 1-methyl-4-(1-methylethylidene)cyclohexene 1-methyl-4-(propan-2-ylidene)cyclohexene p-mentha-1,4(8)-diene 4-isopropylidene-1-methylcyclohexene Terpinolen Terpinolene alpha-terpinolene isoterpinene terpinolene
hmdb:HMDB36994 keggC:M_C06075 seedM:M_cpd03620	secondary/obsolete/fantasy identifier