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

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leptorumol

	Properties	Image
MNX_ID	MNXM106124
reference	chebi:67370
formula	C₁₁H₁₀O₄
global charge	0
mol weight	206.197
InChIKey	OWGYZWMBXRFUQP-UHFFFAOYSA-N
InChI	InChI=1S/C11H10O4/c1-5-9(13)6(2)11-8(10(5)14)7(12)3-4-15-11/h3-4,13-14H,1-2H3
SMILES	CC1=C(O)C(C)=C2OC=CC(=O)C2=C1O

MNX internals

InChI (mnx)	InChI=1/C11H10O4/c1-5-9(13)6(2)11-8(10(5)14)7(12)3-4-15-11/h3-4,13-14H,1-2H3
SMILES (mnx)	[CH3:1][C:5]1=[C:9]([OH:13])[C:6]([CH3:2])=[C:11]2[C:8](=[C:10]1[OH:14])[C:7](=[O:12])[CH:3]=[CH:4][O:15]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:67370 chebi:67370 OWGYZWMBXRFUQP-UHFFFAOYSA-N	leptorumol 5,7-dihydroxy-6,8-dimethyl-4H-chromen-4-one