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Cassiachromone

PropertiesImage
MNX_IDMNXM120315 Image of MNXM120315
referencechebi:168073
formulaC13H12O4
global charge0
mol weight232.235
InChIKeyYMCXDPKFRCHLPK-UHFFFAOYSA-N
InChIInChI=1S/C13H12O4/c1-7(14)3-9-5-10(15)6-12-13(9)11(16)4-8(2)17-12/h4-6,15H,3H2,1-2H3
SMILESCC(=O)CC1=CC(O)=CC2=C1C(=O)C=C(C)O2
MNX internals
InChI (mnx)InChI=1/C13H12O4/c1-7(14)3-9-5-10(15)6-12-13(9)11(16)4-8(2)17-12/h4-6,15H,3H2,1-2H3 Image of MNXM120315
SMILES (mnx)[CH3:1][C:7]([CH2:3][C:9]1=[C:13]2[C:11](=[O:16])[CH:4]=[C:8]([CH3:2])[O:17][C:12]2=[CH:6][C:10]([OH:15])=[CH:5]1)=[O:14]
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
IdentifierDescription

CHEBI:168073
chebi:168073
YMCXDPKFRCHLPK-UHFFFAOYSA-N 		Cassiachromone
7-hydroxy-2-methyl-5-(2-oxopropyl)chromen-4-one
hmdb:HMDB0030813
YMCXDPKFRCHLPK-UHFFFAOYSA-N 		Cassiachromone
2-Methyl-5-acetonyl-7-hydroxychromone
5-Acetonyl-7-hydroxy-2-methyl-chromone
5-Acetonyl-7-hydroxy-2-methylchromone
5-Acetonyl-7-hydroxy-2-methylchromone, 8ci
7-Hydroxy-2-methyl-5-(2-oxopropyl)-4H-1-benzopyran-4-one, 9ci
7-hydroxy-2-methyl-5-(2-oxopropyl)-4H-chromen-4-one
7-hydroxy-2-methyl-5-(2-oxopropyl)chromen-4-one

hmdb:HMDB30813 		secondary/obsolete/fantasy identifier