Aurantiamide acetate
AlkaPlorer ID: AK006780
Synonym: '', '56121-42-7', 'Aurantiamide acetate', 'Asperglaucide'
IUPAC Name: [(2S)-2-[(2-benzamido-3-phenylpropanoyl)amino]-3-phenylpropyl] acetate
Structure
SMILES: CC(=O)OC[C@H](CC1=CC=CC=C1)N=C(O)C(CC1=CC=CC=C1)N=C(O)C1=CC=CC=C1
InChI: InChI=1S/C27H28N2O4/c1-20(30)33-19-24(17-21-11-5-2-6-12-21)28-27(32)25(18-22-13-7-3-8-14-22)29-26(31)23-15-9-4-10-16-23/h2-16,24-25H,17-19H2,1H3,(H,28,32)(H,29,31)/t24-,25?/m0/s1
InChIKey: VZPAURMDJZOGHU-SKCDSABHSA-N
Source
Properties Information
Molecule Weight: 444.5310000000001
TPSA？: 91.48
MolLogP？: 4.733400000000004
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 3
Activities Information
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