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

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pisonin A

	Properties	Image
MNX_ID	MNXM108020
reference	chebi:67358
formula	C₁₁H₁₀O₅
global charge	0
mol weight	222.196
InChIKey	YZBKMZJFKYGNON-UHFFFAOYSA-N
InChI	InChI=1S/C11H10O5/c1-14-8-5-7-9(6(12)3-4-16-7)10(13)11(8)15-2/h3-5,13H,1-2H3
SMILES	COC1=C(OC)C(O)=C2C(=O)C=COC2=C1

MNX internals

InChI (mnx)	InChI=1/C11H10O5/c1-14-8-5-7-9(6(12)3-4-16-7)10(13)11(8)15-2/h3-5,13H,1-2H3
SMILES (mnx)	[CH3:1][O:14][C:8]1=[CH:5][C:7]2=[C:9]([C:6](=[O:12])[CH:3]=[CH:4][O:16]2)[C:10]([OH:13])=[C:11]1[O:15][CH3:2]

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:67358 chebi:67358 YZBKMZJFKYGNON-UHFFFAOYSA-N	pisonin A 5-hydroxy-6,7-dimethoxy-4H-chromen-4-one 5-hydroxy-6,7-dimethoxychromone