Isopregnanolone

• CAS: 516-55-2
• Catalog Number: ACM516552
• Category: Steroidal Compounds
• Molecular Weight: 318.5
• Molecular Formula: C₂₁H₃₄O₂
• Synonyms: Alloepipregnanolone; ALLOPREGNAN-3B-OL-20-ONE; ISOPREGNANOLONE; 3-Hydroxypregnan-20-one; 3beta-hydroxy-5alpha-pregnan-20-one; 5A-PREGNAN-3B-OL-20-ONE; Pregnan-20-one,3-hydroxy-, (3b,5a)-; Tetrahydroprogesterone; epi-allopregnanolone; ALLOPREGNANOLONE
• IUPAC Name: 3β-hydroxy-5α-pregnan-20-one
• Boiling Point: 431.2ºC at 760mmHg
• Flash Point: 183.9ºC
• Density: 1.053g/cm³
• Exact Mass: 318.25600

Custom Q&A

What is the molecular formula of Isopregnanolone?

The molecular formula of Isopregnanolone is C21H34O2.

What are some synonyms of Isopregnanolone?

Some synonyms of Isopregnanolone are Allopregnanolone, Alloepipregnanolone, and Sepranolone.

What is the molecular weight of Isopregnanolone?

The molecular weight of Isopregnanolone is 318.5 g/mol.

What is the IUPAC name of Isopregnanolone?

The IUPAC name of Isopregnanolone is 1-[(3S,5S,8R,9S,10S,13S,14S,17S)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone.

What is the InChIKey of Isopregnanolone?

The InChIKey of Isopregnanolone is AURFZBICLPNKBZ-FZCSVUEKSA-N.

What is the canonical SMILES representation of Isopregnanolone?

The canonical SMILES representation of Isopregnanolone is CC(=O)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C).

What is the EC number of Isopregnanolone?

The European Community (EC) Number of Isopregnanolone is 208-224-2.

What is the ChEMBL ID of Isopregnanolone?

The ChEMBL ID of Isopregnanolone is CHEMBL2057301.

What is the XLogP3-AA value of Isopregnanolone?

The XLogP3-AA value of Isopregnanolone is 4.9.

What is the topological polar surface area of Isopregnanolone?

The topological polar surface area of Isopregnanolone is 37.3Ų.