(4R,5S,6S,7R)-5,6-Dihydroxy-1,3-Bis[[4-(Hydroxymethyl)Phenyl]Methyl]-4,7-Bis(Phenylmethyl)-1,3-Diazepan-2-One
[CAS# 151867-81-1]

Identification

• Name: (4R,5S,6S,7R)-5,6-Dihydroxy-1,3-Bis[[4-(Hydroxymethyl)Phenyl]Methyl]-4,7-Bis(Phenylmethyl)-1,3-Diazepan-2-One
• Synonyms: (4R,5S,6S,7R)-4,7-Bis(Benzyl)-5,6-Dihydroxy-1,3-Bis(4-Methylolbenzyl)-1,3-Diazepan-2-One; Aids-005340; Aids005340
• Molecular Formula: C₃₅H₃₈N₂O₅
• Molecular Weight: 566.70
• CAS Registry Number: 151867-81-1
• SMILES: [C@@H]1(N(C(=O)N([C@@H]([C@H](O)[C@H]1O)CC2=CC=CC=C2)CC3=CC=C(C=C3)CO)CC4=CC=C(C=C4)CO)CC5=CC=CC=C5
• InChI: 1S/C35H38N2O5/c38-23-29-15-11-27(12-16-29)21-36-31(19-25-7-3-1-4-8-25)33(40)34(41)32(20-26-9-5-2-6-10-26)37(35(36)42)22-28-13-17-30(24-39)18-14-28/h1-18,31-34,38-41H,19-24H2/t31-,32-,33+,34+/m1/s1
• InChIKey: XCVGQMUMMDXKCY-WZJLIZBTSA-N

Properties

• Density: 1.295g/cm³ (Cal.)
• Boiling point: 798.626°C at 760 mmHg (Cal.)
• Flash point: 436.793°C (Cal.)