(3S,10S,13R,14S,17R)-3-Hydroxy-4,4,10,13-Tetramethyl-17-[(2R)-6-Methylhept-5-En-2-Yl]-2,3,5,6,7,11,12,15,16,17-Decahydro-1H-Cyclopenta[a]Phenanthrene-14-Carbaldehyde
[CAS# 79294-83-0]

Identification

• Name: (3S,10S,13R,14S,17R)-3-Hydroxy-4,4,10,13-Tetramethyl-17-[(2R)-6-Methylhept-5-En-2-Yl]-2,3,5,6,7,11,12,15,16,17-Decahydro-1H-Cyclopenta[a]Phenanthrene-14-Carbaldehyde
• Synonyms: (3S,10S,13R,14S,17R)-17-[(1R)-1,5-Dimethylhex-4-Enyl]-3-Hydroxy-4,4,10,13-Tetramethyl-2,3,5,6,7,11,12,15,16,17-Decahydro-1H-Cyclopenta[A]Phenanthrene-14-Carbaldehyde; (3S,10S,13R,14S,17R)-17-[(1R)-1,5-Dimethylhex-4-Enyl]-3-Hydroxy-4,4,10,13-Tetramethyl-2,3,5,6,7,11,12,15,16,17-Decahydro-1H-Cyclopenta[A]Phenanthrene-14-Carboxaldehyde; 32-Ketolanosterol
• Molecular Formula: C₃₀H₄₈O₂
• Molecular Weight: 440.71
• CAS Registry Number: 79294-83-0
• SMILES: [C@@]12([C@@]([C@H](CC1)[C@@H](CCC=C(C)C)C)(CCC3=C2CCC4[C@@]3(CC[C@H](O)C4(C)C)C)C)C=O
• InChI: 1S/C30H48O2/c1-20(2)9-8-10-21(3)22-14-18-30(19-31)24-11-12-25-27(4,5)26(32)15-16-28(25,6)23(24)13-17-29(22,30)7/h9,19,21-22,25-26,32H,8,10-18H2,1-7H3/t21-,22-,25?,26+,28-,29-,30-/m1/s1
• InChIKey: PGGIMLIQOHYFIS-DHVLVQQASA-N

Properties

• Density: 1.028g/cm³ (Cal.)
• Boiling point: 524.488°C at 760 mmHg (Cal.)
• Flash point: 221.534°C (Cal.)