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Pseudoisoeugenol 2-methylbutanoate

PropertiesImage
MNX_IDMNXM130058 Image of MNXM130058
referencehmdb:HMDB0035503
formulaC15H20O3
global charge0
mol weight248.322
InChIKeyYARRWVYKHJNVHX-FNORWQNLSA-N
InChIInChI=1S/C15H20O3/c1-5-7-12-10-13(17-4)8-9-14(12)18-15(16)11(3)6-2/h5,7-11H,6H2,1-4H3/b7-5+
SMILESC/C=C/C1=C(OC(=O)C(C)CC)C=CC(OC)=C1
MNX internals
InChI (mnx)InChI=1/C15H20O3/c1-5-7-12-10-13(17-4)8-9-14(12)18-15(16)11(3)6-2/h5,7-11H,6H2,1-4H3/b7-5+/t11? Image of MNXM130058
SMILES (mnx)[CH3:1]/[CH:5]=[CH:7]/[C:12]1=[C:14]([O:18][C:15]([CH:11]([CH3:3])[CH2:6][CH3:2])=[O:16])[CH:9]=[CH:8][C:13]([O:17][CH3:4])=[CH:10]1
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
hmdb:HMDB0035503
YARRWVYKHJNVHX-FNORWQNLSA-N 		Pseudoisoeugenol 2-methylbutanoate
4-Methoxy-2-(prop-1-en-1-yl)phenyl 2-methylbutanoic acid
4-methoxy-2-[(1E)-prop-1-en-1-yl]phenyl 2-methylbutanoate
Pseudoisoeugenol 2-methylbutanoic acid

hmdb:HMDB35503 		secondary/obsolete/fantasy identifier