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

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myristicin

	Properties	Image
MNX_ID	MNXM106817
reference	chebi:68234
formula	C₁₁H₁₂O₃
global charge	0
mol weight	192.214
InChIKey	BNWJOHGLIBDBOB-UHFFFAOYSA-N
InChI	InChI=1S/C11H12O3/c1-3-4-8-5-9(12-2)11-10(6-8)13-7-14-11/h3,5-6H,1,4,7H2,2H3
SMILES	C=CCC1=CC(OC)=C2OCOC2=C1

MNX internals

InChI (mnx)	InChI=1/C11H12O3/c1-3-4-8-5-9(12-2)11-10(6-8)13-7-14-11/h3,5-6H,1,4,7H2,2H3
SMILES (mnx)	[CH2:1]=[CH:3][CH2:4][C:8]1=[CH:5][C:9]([O:12][CH3:2])=[C:11]2[C:10](=[CH:6]1)[O:13][CH2:7][O:14]2

Parent-child relations graph

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

Similar chemical compounds in external resources
Identifier	Description
CHEBI:68234 chebi:68234 BNWJOHGLIBDBOB-UHFFFAOYSA-N	myristicin 1,3-Benzodioxole, 4-methoxy-6-(2-propenyl)- 6-Allyl-4-methoxy-1,3-benzodioxole Benzene, 5-allyl-1-methoxy-2,3-(methylenedioxy)- Myristicin
seed.compound:cpd07366 seedM:cpd07366 kegg.compound:C10480 keggC:C10480 BNWJOHGLIBDBOB-UHFFFAOYSA-N	Myristicin
hmdb:HMDB0035873 BNWJOHGLIBDBOB-UHFFFAOYSA-N	Myristicin 1,3-Benzodioxole, 4-methoxy-6-(2-propenyl)- (9ci) 1-Allyl-3-methoxy-4,5-methylenedioxybenzene 1-Methoxy-2,3-methylenedioxy-5-(2-propenyl)benzene 4-Methoxy-6-(2-propenyl)-1,3-benzodioxole 4-Methoxy-6-(2-propenyl)-1,3-benzodioxole, 9ci 4-Methoxy-6-[2-propenyl]-1,3-benzodioxole 4-methoxy-6-(prop-2-en-1-yl)-2H-1,3-benzodioxole 5-Allyl-1-methoxy-2,3-(methylenedioxy)-benzene 5-Allyl-1-methoxy-2,3-(methylenedioxy)benzene 5-Allyl-2,3-(methylendioxy)anisole 6-Allyl-4-methoxy-1,3-benzodioxole Asaricin Myristicin (6ci) Myristicin from parsley leaf oil Myristicine myristicin
hmdb:HMDB35873 chebi:7057 keggC:M_C10480 seedM:M_cpd07366	secondary/obsolete/fantasy identifier