Epiallopregnanolone

• CAS: 567-01-1
• Catalog Number: ACM567011
• Category: Steroidal Compounds
• Molecular Weight: 334.49
• Molecular Formula: C₂₁H₃₄O₃
• Synonyms: 5-ALPHA-PREGNAN-3-BETA, 21-DIOL-20-ONE;3-BETA,5-ALPHA-TETRAHYDRODEOSOXYCORTICOSTERONE;5-A-pregnane-3-B-21-diol-20-one
• IUPAC Name: 2-hydroxy-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
• Canonical SMILES: CC12CCC(CC1CCC3C2CCC4(C3CCC4C(=O)CO)C)O
• InChI Key: CYKYBWRSLLXBOW-VTBMCCKRSA-N
• Exact Mass: 334.25100
• H-Bond Acceptor: 3
• H-Bond Donor: 2

Custom Q&A

What is the molecular formula of Epiallopregnanolone?

The molecular formula of Epiallopregnanolone is C21H34O2.

What are some synonyms for Epiallopregnanolone?

Some synonyms for Epiallopregnanolone are Isopregnanolone, Allopregnanolone, Alloepipregnanolone, and Sepranolone.

What is the molecular weight of Epiallopregnanolone?

The molecular weight of Epiallopregnanolone is 318.5 g/mol.

What is the IUPAC name of Epiallopregnanolone?

The IUPAC name of Epiallopregnanolone 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 Epiallopregnanolone?

The InChIKey of Epiallopregnanolone is AURFZBICLPNKBZ-FZCSVUEKSA-N.

What is the Canonical SMILES of Epiallopregnanolone?

The Canonical SMILES of Epiallopregnanolone is CC(=O)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C).

What is the CAS number of Epiallopregnanolone?

The CAS number of Epiallopregnanolone is 516-55-2.

What is the XLogP3-AA value of Epiallopregnanolone?

The XLogP3-AA value of Epiallopregnanolone is 4.9.

How many hydrogen bond acceptors are present in Epiallopregnanolone?

There are 2 hydrogen bond acceptors present in Epiallopregnanolone.

What is the topological polar surface area of Epiallopregnanolone?

The topological polar surface area of Epiallopregnanolone is 37.3Ų.