(7S,13E,16S,18R,19E,21R)-21-(Acetyloxy)-7,18-Dihydroxy-16,18-Dimethyl-10-Phenyl-(11)Cytochalasa-5,13,19-Trien-1-One
[CAS# 108050-28-8]

Identification

• Name: (7S,13E,16S,18R,19E,21R)-21-(Acetyloxy)-7,18-Dihydroxy-16,18-Dimethyl-10-Phenyl-(11)Cytochalasa-5,13,19-Trien-1-One
• Synonyms: 1H-Cycloundec(D)Isoindol-1-One, 15-(Acetyloxy)-2,3,3A,6,6A,9,10,11,12,15-Decahydro-6,12-Dihydroxy-4,5,10,12-Tetramethyl-3-(Phenylmethyl)-, (3S,3Ar,6S,6Ar,7E,10S,12R,13E,15R,15Ar)-; 1H-Cycloundec(D)Isoindol-1-One, 15-(Acetyloxy)-2,3,3A,6,6A,9,10,11,12,15-Decahydro-6,12-Dihydroxy-4,5,10,12-Tetramethyl-3-(Phenylmethyl)-, (3S-(3R*,3As*,6R*,6As*,7E,10R*,12S*,13E,15S*,15As*))-; Cytochalasin Npho
• Molecular Formula: C₃₀H₃₉NO₅
• Molecular Weight: 493.64
• CAS Registry Number: 108050-28-8
• SMILES: C4=C(CC1NC(=O)C23C1C(=C(C(O)C2\C=C\CC(CC(O)(/C=C/C3OC(=O)C)C)C)C)C)C=CC=C4
• InChI: 1S/C30H39NO5/c1-18-10-9-13-23-27(33)20(3)19(2)26-24(16-22-11-7-6-8-12-22)31-28(34)30(23,26)25(36-21(4)32)14-15-29(5,35)17-18/h6-9,11-15,18,23-27,33,35H,10,16-17H2,1-5H3,(H,31,34)/b13-9+,15-14+
• InChIKey: WFSYATBEJTUDQA-BBXOWAOSSA-N

Properties

• Density: 1.202g/cm³ (Cal.)
• Boiling point: 678.573°C at 760 mmHg (Cal.)
• Flash point: 364.188°C (Cal.)