Cryptophycin-46
[CAS# 124689-64-1]

Identification

• Name: Cryptophycin-46
• Synonyms: (13Z)-10-[(3-Chloro-4-Methoxy-Phenyl)Methyl]-3-Isobutyl-6-Methyl-16-[(E)-1-Methyl-3-Phenyl-Prop-2-Enyl]-1,4-Dioxa-8,11-Diazacyclohexadec-13-Ene-2,5,9,12-Tetrone; (13Z)-10-[(3-Chloro-4-Methoxyphenyl)Methyl]-3-Isobutyl-6-Methyl-16-[(E)-1-Methyl-3-Phenylprop-2-Enyl]-1,4-Dioxa-8,11-Diazacyclohexadec-13-Ene-2,5,9,12-Tetrone; (13Z)-10-(3-Chloro-4-Methoxy-Benzyl)-3-Isobutyl-6-Methyl-16-[(E)-1-Methyl-3-Phenyl-Prop-2-Enyl]-1,4-Dioxa-8,11-Diazacyclohexadec-13-Ene-2,5,9,12-Diquinone
• Molecular Formula: C₃₅H₄₃ClN₂O₇
• Molecular Weight: 639.19
• CAS Registry Number: 124689-64-1
• SMILES: C1=C(Cl)C(=CC=C1CC2NC(=O)\C=C/CC(OC(=O)C(OC(=O)C(CNC2=O)C)CC(C)C)C(\C=C\C3=CC=CC=C3)C)OC
• InChI: 1S/C35H43ClN2O7/c1-22(2)18-31-35(42)44-29(23(3)14-15-25-10-7-6-8-11-25)12-9-13-32(39)38-28(33(40)37-21-24(4)34(41)45-31)20-26-16-17-30(43-5)27(36)19-26/h6-11,13-17,19,22-24,28-29,31H,12,18,20-21H2,1-5H3,(H,37,40)(H,38,39)/b13-9-,15-14+
• InChIKey: QLGFKEFRTAOKJU-JIIHXHDGSA-N

Properties

• Density: 1.134g/cm³ (Cal.)
• Boiling point: 872.611°C at 760 mmHg (Cal.)
• Flash point: 481.538°C (Cal.)