CHEBI:91492 - 3-[[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxoethyl]hydrazo]-3-oxo-2-phenylpropanoic acid (phenylmethyl) ester

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-[[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxoethyl]hydrazo]-3-oxo-2-phenylpropanoic acid (phenylmethyl) ester
ChEBI ID CHEBI:91492
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C23H27N3O6
Net Charge 0
Average Mass 441.478
Monoisotopic Mass 441.18999
InChI InChI=1S/C23H27N3O6/c1-23(2,3)32-22(30)24-14-18(27)25-26-20(28)19(17-12-8-5-9-13-17)21(29)31-15-16-10-6-4-7-11-16/h4-13,19H,14-15H2,1-3H3,(H,24,30)(H,25,27)(H,26,28)
InChIKey MNZQMCZAJPXZMM-UHFFFAOYSA-N
SMILES CC(C)(C)OC(=O)NCC(=O)NNC(=O)C(C1=CC=CC=C1)C(=O)OCC2=CC=CC=C2
ChEBI Ontology
Outgoing 3-[[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxoethyl]hydrazo]-3-oxo-2-phenylpropanoic acid (phenylmethyl) ester (CHEBI:91492) has functional parent benzyl alcohol (CHEBI:17987)
3-[[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxoethyl]hydrazo]-3-oxo-2-phenylpropanoic acid (phenylmethyl) ester (CHEBI:91492) is a carboxylic ester (CHEBI:33308)
Manual Xref Database
LSM-1262 LINCS
View more database links