Inokosterone

• CAS: 15130-85-5
• Catalog Number: ACM15130855
• Category: Steroidal Compounds
• Molecular Weight: 480.64
• Molecular Formula: C₂₇H₄₄O₇
• Synonyms: Inokosterone
• IUPAC Name: (2S,3R,5R,9R,10R,13R,14S,17S)-2,3,14-trihydroxy-10,13-dimethyl-17-[(2R,3R,6R)-2,3,7-trihydroxy-6-methylheptan-2-yl]-2,3,4,5,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-6-one
• Canonical SMILES: CC(CCC(C(C)(C1CCC2(C1(CCC3C2=CC(=O)C4C3(CC(C(C4)O)O)C)C)O)O)O)CO
• InChI Key: JQNVCUBPURTQPQ-GYVHUXHASA-N
• Boiling Point: 713.2ºC at 760mmHg
• Flash Point: 399.1ºC
• Density: 1.28g/cm³
• Exact Mass: 480.30900
• H-Bond Acceptor: 7
• H-Bond Donor: 6

Custom Q&A

What is the PubChem CID for inokosterone?

The PubChem CID for inokosterone is 441828.

What is the molecular formula of inokosterone?

The molecular formula of inokosterone is C27H44O7.

What are the synonyms for inokosterone?

The synonyms for inokosterone are 25R-Inokosterone, 19682-38-3, and 15130-85-5.

What is the molecular weight of inokosterone?

The molecular weight of inokosterone is 480.6 g/mol.

When was inokosterone created?

Inokosterone was created on June 24, 2005.

When was inokosterone last modified?

Inokosterone was last modified on November 25, 2023.

Where is inokosterone found?

Inokosterone is found in Zoanthus, Rhaponticum carthamoides, and other organisms.

What is the IUPAC name of inokosterone?

The IUPAC name of inokosterone is (2S,3R,5R,9R,10R,13R,14S,17S)-2,3,14-trihydroxy-10,13-dimethyl-17-[(2R,3R,6R)-2,3,7-trihydroxy-6-methylheptan-2-yl]-2,3,4,5,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-6-one.

What is the InChI Key of inokosterone?

The InChI Key of inokosterone is JQNVCUBPURTQPQ-GYVHUXHASA-N.

What is the canonical SMILES of inokosterone?

The canonical SMILES of inokosterone is CC(CCC(C(C)(C1CCC2(C1(CCC3C2=CC(=O)C4C3(CC(C(C4)O)O)C)C)O)O)O)CO.