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Structure

17-Hydroxy-6-methylpregna-4,6-diene-3,20-dione

CAS
3562-63-8
Catalog Number
ACM3562638
Category
Steroidal Compounds
Molecular Weight
342.47
Molecular Formula
C22H30O3

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Specification

Synonyms
17-hydroxy-6-methylpregna-4,6-diene-3,20-dione;20-dione,17-hydroxy-6-methyl-pregna-6-diene-3;4,6-PREGNADIEN-6-METHYL-17-OL-3,20-DIONE;17-ALPHA-HYDROXY-6-METHYL-4,6-PREGNADIENE-3,20-DIONE;MEGESTROL;17-alpha-hydroxy-6-methylpregna-4,6-diene-3,20-dione;Mege
IUPAC Name
(8R,9S,10R,13S,14S,17R)-17-acetyl-17-hydroxy-6,10,13-trimethyl-2,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthren-3-one
Canonical SMILES
CC1=CC2C(CCC3(C2CCC3(C(=O)C)O)C)C4(C1=CC(=O)CC4)C
InChI Key
VXIMPSPISRVBPZ-NWUMPJBXSA-N
Boiling Point
500.4ºC at 760 mmHg
Flash Point
270.5ºC
Density
1.15 g/cm³
Appearance
white solid
EC Number
222-628-6
Exact Mass
342.21900
What is the molecular formula of megestrol?

The molecular formula of megestrol is C22H30O3.

What is the molecular weight of megestrol?

The molecular weight of megestrol is 342.5 g/mol.

What is the IUPAC name of megestrol?

The IUPAC name of megestrol is (8R,9S,10R,13S,14S,17R)-17-acetyl-17-hydroxy-6,10,13-trimethyl-2,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthren-3-one.

What is the InChI of megestrol?

The InChI of megestrol is InChI=1S/C22H30O3/c1-13-11-16-17(20(3)8-5-15(24)12-19(13)20)6-9-21(4)18(16)7-10-22(21,25)14(2)23/h11-12,16-18,25H,5-10H2,1-4H3/t16-,17+,18+,20-,21+,22+/m1/s1.

What is the InChIKey of megestrol?

The InChIKey of megestrol is VXIMPSPISRVBPZ-NWUMPJBXSA-N.

What is the CAS number of megestrol?

The CAS number of megestrol is 3562-63-8.

What is the common name of megestrol?

The common name of megestrol is Megestrol.

What is the pharmacological class of megestrol?

The pharmacological class of megestrol is Progestin.

What is the XLogP3-AA value of megestrol?

The XLogP3-AA value of megestrol is 2.6.

How many hydrogen bond donors does megestrol have?

Megestrol has 1 hydrogen bond donor.

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