ChemInfo: Search Results - Detail of an entry

Catalog ID

BB_NC-00126

Iupac name

1-((3S,8S,9S,10R,13S,14S,17S)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)ethanone

Structure

Molecular Formula

C₂₁H₃₂O₂

Molecular Weight

316.48388

SMILES

O[C@H]1CC[C@]2(C(=CC[C@@H]3[C@@H]2CC[C@]2([C@H]3CC[C@@H]2C(=O)C)C)C1)C

Rotatable Bonds

H Bond Donors

H Bond Acceptors

Rings

logP

4.026999999999999

PSA

37.3

Class

	Alcohols
	Aldehydes & Ketones
	Steroids & Terpenoids

InChI

InChI=1S/C21H32O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h4,15-19,23H,5-12H2,1-3H3/t15-,16-,17+,18-,19-,20-,21+/m0/s1

InChIKey

ORNBQBCIOKFOEO-QGVNFLHTSA-N

Prices

BB_NC-00126	500mg	Get offer
BB_NC-00126	1g	Get offer
BB_NC-00126	5g	Get offer
BB_NC-00126	10g	Get offer