Tetrahydrocortisone 3-glucuronide

• CAS: 26312-91-4
• Catalog Number: ACM26312914
• Category: Steroidal Compounds
• Molecular Weight: 540.6
• Molecular Formula: C₂₇H₄₀O₁₁

Custom Q&A

What is the molecular formula of Tetrahydrocortisone 3-glucuronide?

The molecular formula is C27H40O11.

What are the synonyms for Tetrahydrocortisone 3-glucuronide?

The synonyms are Tetrahydrocortisone 3-Glucuronide and 26312-91-4.

What is the molecular weight of Tetrahydrocortisone 3-glucuronide?

The molecular weight is 540.6 g/mol.

When was Tetrahydrocortisone 3-glucuronide created and modified?

It was created on December 11, 2015, and last modified on December 2, 2023.

What is the IUPAC Name of Tetrahydrocortisone 3-glucuronide?

The IUPAC Name is (2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(3R,5R,8S,9S,10S,13S,14S,17R)-17-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-11-oxo-2,3,4,5,6,7,8,9,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]oxane-2-carboxylic acid.

What is the InChI of Tetrahydrocortisone 3-glucuronide?

The InChI is InChI=1S/C27H40O11/c1-25-7-5-13(37-24-21(33)19(31)20(32)22(38-24)23(34)35)9-12(25)3-4-14-15-6-8-27(36,17(30)11-28)26(15,2)10-16(29)18(14)25/h12-15,18-22,24,28,31-33,36H,3-11H2,1-2H3,(H,34,35)/t12-,13-,14+,15+,18-,19+,20+,21-,22+,24-,25+,26+,27+/m1/s1.

What is the InChIKey of Tetrahydrocortisone 3-glucuronide?

The InChIKey is QUOCEDQXFGCYTL-WPIYVXEUSA-N.

What is the Canonical SMILES of Tetrahydrocortisone 3-glucuronide?

The Canonical SMILES is CC12CCC(CC1CCC3C2C(=O)CC4(C3CCC4(C(=O)CO)O)C)OC5C(C(C(C(O5)C(=O)O)O)O)O.

What is the XLogP3-AA value of Tetrahydrocortisone 3-glucuronide?

The XLogP3-AA value is 0.8.

What is the hydrogen bond acceptor count of Tetrahydrocortisone 3-glucuronide?

The hydrogen bond acceptor count is 11.