Structure

11-Alpha-hydroxy-4-pregnene-3,20-dione 11-hemisuccinate

CAS
41238-98-6
Catalog Number
ACM41238986
Category
Main Products
Molecular Weight
430.5
Molecular Formula
C25H34O6

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What is the molecular formula of 11-Alpha-hydroxy-4-pregnene-3,20-dione 11-hemisuccinate?

The molecular formula is C25H34O6.

What is the PubChem CID of 11-Alpha-hydroxy-4-pregnene-3,20-dione 11-hemisuccinate?

The PubChem CID is 91873606.

What is the IUPAC name of 11-Alpha-hydroxy-4-pregnene-3,20-dione 11-hemisuccinate?

The IUPAC name is 4-[[(8S,9S,10R,11R,13R,14S,17S)-17-acetyl-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-11-yl]oxy]-4-oxobutanoic acid.

What is the InChI of 11-Alpha-hydroxy-4-pregnene-3,20-dione 11-hemisuccinate?

The InChI is InChI=1S/C25H34O6/c1-14(26)18-6-7-19-17-5-4-15-12-16(27)10-11-24(15,2)23(17)20(13-25(18,19)3)31-22(30)9-8-21(28)29/h12,17-20,23H,4-11,13H2,1-3H3,(H,28,29)/t17-,18+,19-,20+,23+,24-,25-/m0/s1.

What is the molecular weight of 11-Alpha-hydroxy-4-pregnene-3,20-dione 11-hemisuccinate?

The molecular weight is 430.5 g/mol.

What is the XLogP3 value of 11-Alpha-hydroxy-4-pregnene-3,20-dione 11-hemisuccinate?

The XLogP3 value is 2.4.

How many hydrogen bond donor counts are there in 11-Alpha-hydroxy-4-pregnene-3,20-dione 11-hemisuccinate?

There is 1 hydrogen bond donor count.

How many hydrogen bond acceptor counts are there in 11-Alpha-hydroxy-4-pregnene-3,20-dione 11-hemisuccinate?

There are 6 hydrogen bond acceptor counts.

How many rotatable bond counts are there in 11-Alpha-hydroxy-4-pregnene-3,20-dione 11-hemisuccinate?

There are 6 rotatable bond counts.

What is the topological polar surface area of 11-Alpha-hydroxy-4-pregnene-3,20-dione 11-hemisuccinate?

The topological polar surface area is 97.7Ų.

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