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Pregn-20-yne-3,17-diol, (3alpha,5beta,17alpha)- , Androgen Receptor modulator, CAS No.118753639, Androgen Receptor modulator

COA

Molecular Weight: 316.5
PubChem CID: 118753639

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Item Number

P671316

Grouped product items
SKU	Size	Availability	Price	Qty
P671316-1mg	1mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$999.90

Basic Description

Synonyms	pregn-20-yne-3,17-diol, (3alpha,5beta,17alpha)- \| HE-3235 \| (10S,13S,17R)-17-ethynyl-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-3,17-diol \| CHEMBL3545237
Action Type	MODULATOR
Mechanism of action	Androgen Receptor modulator

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Lipids and lipid-like molecules
  - Class Steroids and steroid derivatives
    - Subclass Androstane steroids

Kingdom	Organic compounds
Superclass	Lipids and lipid-like molecules
Class	Steroids and steroid derivatives
Subclass	Androstane steroids
Intermediate Tree Nodes	Not available
Direct Parent	Androgens and derivatives
Alternative Parents	3-hydroxysteroids 17-hydroxysteroids Ynones Tertiary alcohols Secondary alcohols Cyclic alcohols and derivatives Acetylides Hydrocarbon derivatives
Molecular Framework	Aliphatic homopolycyclic compounds
Substituents	Androgen-skeleton - 17-hydroxysteroid - Hydroxysteroid - 3-hydroxysteroid - Ynone - Tertiary alcohol - Cyclic alcohol - Secondary alcohol - Acetylide - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Alcohol - Aliphatic homopolycyclic compound
Description	This compound belongs to the class of organic compounds known as androgens and derivatives. These are 3-hydroxylated C19 steroid hormones. They are known to favor the development of masculine characteristics. They also show profound effects on scalp and body hair in humans.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

IUPAC Name	(10S,13S,17R)-17-ethynyl-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-3,17-diol
INCHI	InChI=1S/C21H32O2/c1-4-21(23)12-9-18-16-6-5-14-13-15(22)7-10-19(14,2)17(16)8-11-20(18,21)3/h1,14-18,22-23H,5-13H2,2-3H3/t14?,15?,16?,17?,18?,19-,20-,21-/m0/s1
InChIKey	CKAXZOYFIHQCBN-UQOAMHMYSA-N
Smiles	CC12CCC(CC1CCC3C2CCC4(C3CCC4(C#C)O)C)O
Isomeric SMILES	C[C@]12CCC(CC1CCC3C2CC[C@]4(C3CC[C@]4(C#C)O)C)O
PubChem CID	118753639
Molecular Weight	316.5

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