UNPD189613
AlkaPlorer ID: AK252235
Synonym: None
IUPAC Name: methyl (2S)-2-[[2-[(4S)-3,5-dioxo-4-phenyloxolan-2-ylidene]-2-phenylacetyl]amino]-3-phenylpropanoate
Structure
SMILES: COC(=O)[C@H](CC1=CC=CC=C1)N=C(O)C(=C1OC(=O)[C@@H](C2=CC=CC=C2)C1=O)C1=CC=CC=C1
InChI: InChI=1S/C28H23NO6/c1-34-27(32)21(17-18-11-5-2-6-12-18)29-26(31)23(20-15-9-4-10-16-20)25-24(30)22(28(33)35-25)19-13-7-3-8-14-19/h2-16,21-22H,17H2,1H3,(H,29,31)/t21-,22-/m0/s1
InChIKey: DGBXJRCEHHYSJC-VXKWHMMOSA-N
Source
Properties Information
Molecule Weight: 469.49300000000017
TPSA？: 102.26
MolLogP？: 4.048200000000003
Number of H-Donors: 1
Number of H-Acceptors: 6
RingCount: 4
Activities Information
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