Structure

Methyl 1,3-dihydroxycholan-24-oate

CAS
90134-61-5
Catalog Number
ACM90134615
Category
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What is the molecular formula of Methyl 1,3-dihydroxycholan-24-oate?

The molecular formula of Methyl 1,3-dihydroxycholan-24-oate is C25H42O4.

When was Methyl 1,3-dihydroxycholan-24-oate created and last modified?

Methyl 1,3-dihydroxycholan-24-oate was created on 2005-08-08 and last modified on 2023-12-30.

What is the computed molecular weight of Methyl 1,3-dihydroxycholan-24-oate?

The computed molecular weight of Methyl 1,3-dihydroxycholan-24-oate is 406.6 g/mol.

What are the synonyms for Methyl 1,3-dihydroxycholan-24-oate?

Some synonyms for Methyl 1,3-dihydroxycholan-24-oate are DTXSID201009174 and methyl (4R)-4-[(1S,3S,5R,8S,9S,10S,13R,14S,17S)-1,3-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate.

What is the IUPAC name of Methyl 1,3-dihydroxycholan-24-oate?

The IUPAC name of Methyl 1,3-dihydroxycholan-24-oate is methyl (4R)-4-[(1S,3S,5R,8S,9S,10S,13R,14S,17S)-1,3-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate.

What is the InChIKey of Methyl 1,3-dihydroxycholan-24-oate?

The InChIKey of Methyl 1,3-dihydroxycholan-24-oate is OKPBKPSSYICCDG-MSJOIBKGSA-N.

How many hydrogen bond donor counts does Methyl 1,3-dihydroxycholan-24-oate have?

Methyl 1,3-dihydroxycholan-24-oate has 2 hydrogen bond donor counts.

What is the XLogP3-AA value of Methyl 1,3-dihydroxycholan-24-oate?

The XLogP3-AA value of Methyl 1,3-dihydroxycholan-24-oate is 5.6.

How many hydrogen bond acceptor counts does Methyl 1,3-dihydroxycholan-24-oate have?

Methyl 1,3-dihydroxycholan-24-oate has 4 hydrogen bond acceptor counts.

How many defined atom stereocenter counts does Methyl 1,3-dihydroxycholan-24-oate have?

Methyl 1,3-dihydroxycholan-24-oate has 10 defined atom stereocenter counts.

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