11-alpha-Hydroxycarvenone

• CAS: 192569-17-8
• Catalog Number: ACM192569178-1
• Category: Steroidal Compounds
• Molecular Weight: 356.46
• Molecular Formula: C22H28O4
• Synonyms: 11-α-Hydroxycarvenone
• IUPAC Name: (8S,9S,10R,11R,13S,14S,17R)-11-hydroxy-10,13-dimethylspiro[2,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthrene-17,5'-oxolane]-2',3-dione
• Canonical SMILES: CC12CCC(=O)C=C1C=CC3C2C(CC4(C3CCC45CCC(=O)O5)C)O
• InChI: RJTDWMKVQUPGSY-NYTLBARGSA-N
• InChI Key: InChI=1S/C22H28O4/c1-20-8-5-14(23)11-13(20)3-4-15-16-6-9-22(10-7-18(25)26-22)21(16,2)12-17(24)19(15)20/h3-4,11,15-17,19,24H,5-10,12H2,1-2H3/t15-,16-,17+,19+,20-,21-,22+/m0/s1
• Boiling Point: 584.7±50.0 °C(Predicted)
• Melting Point: 232-234 °C
• Flash Point: 207.3 °C
• Density: 1.25 g/cm3
• Appearance: Yellow crystalline solid
• EC Number: 606-276-4
• Exact Mass: 356.19900
• H-Bond Acceptor: 4
• H-Bond Donor: 1
• Isomeric SMILES: C[C@]12CCC(=O)C=C1C=C[C@@H]3[C@@H]2[C@@H](C[C@]4([C@H]3CC[C@@]45CCC(=O)O5)C)O

Custom Q&A

What is the PubChem CID for 11-Alpha-hydroxycarvenone?

PubChem CID: 10861210

What is the molecular formula of 11-Alpha-hydroxycarvenone?

Molecular Formula: C22H28O4

What are the synonyms for 11-Alpha-hydroxycarvenone?

Synonyms: 11alpha-Hydroxycanrenone, 192569-17-8, 11-alpha-Hydroxycarvenone, (8S,9S,10R,11R,13S,14S,17R)-11-hydroxy-10,13-dimethylspiro[2,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthrene-17,5'-oxolane]-2',3-dione, Pregna-4,6-diene-21-carboxylic acid, 11,17-dihydroxy-3-oxo-, gamma-lactone, (11alpha,17alpha)-

What is the molecular weight of 11-Alpha-hydroxycarvenone?

Molecular Weight: 356.5 g/mol

What is the IUPAC name of 11-Alpha-hydroxycarvenone?

IUPAC Name: (8S,9S,10R,11R,13S,14S,17R)-11-hydroxy-10,13-dimethylspiro[2,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthrene-17,5'-oxolane]-2',3-dione

What is the InChI of 11-Alpha-hydroxycarvenone?

InChI: InChI=1S/C22H28O4/c1-20-8-5-14(23)11-13(20)3-4-15-16-6-9-22(10-7-18(25)26-22)21(16,2)12-17(24)19(15)20/h3-4,11,15-17,19,24H,5-10,12H2,1-2H3/t15-,16-,17+,19+,20-,21-,22+/m0/s1

What is the InChIKey of 11-Alpha-hydroxycarvenone?

InChIKey: RJTDWMKVQUPGSY-NYTLBARGSA-N

What is the Canonical SMILES of 11-Alpha-hydroxycarvenone?

Canonical SMILES: CC12CCC(=O)C=C1C=CC3C2C(CC4(C3CCC45CCC(=O)O5)C)O

How many hydrogen bond donors are there in 11-Alpha-hydroxycarvenone?

Hydrogen Bond Donor Count: 1