5Beta-Androstane-3Alpha,17Beta-diol 3-Glucuronide
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- structure.search.product.name 5Beta-Androstane-3Alpha,17Beta-diol 3-Glucuronide
- Product Code: TRC-A638060
- CAS Number: 114761-91-0
- Brand: TRC
Product Overview
Product Code
TRC-A638060
CAS Number
Product Format
Neat
Molecular Formula
C25H40O8
Molecular Weight
468.50
Product Categories
Product Type
Bioactive small moleculeDocumentation
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Product Information
Chemical Data
Analyte Name
5b-Androstane-3a,17b-diol-3-b-glucuronic acid
CAS Number
114761-91-0
Molecular Formula
C25H40O8
Molecular Weight
468.50
Accurate Mass
468.5803
SMILES
C[C@]12CC[C@H]3[C@@H](CC[C@@H]4C[C@@H](CC[C@]34C)O[C@@H]5O[C@@H]([C@@H](O)[C@H](O)[C@H]5O)C(=O)O)[C@@H]1CC[C@@H]2O
InChI
InChI=1S/C25H40O8/c1-24-9-7-13(32-23-20(29)18(27)19(28)21(33-23)22(30)31)11-12(24)3-4-14-15-5-6-17(26)25(15,2)10-8-16(14)24/h12-21,23,26-29H,3-11H2,1-2H3,(H,30,31)/t12-,13-,14+,15+,16+,17+,18+,19+,20-,21+,23-,24+,25+/m1/s1
IUPAC
(2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(3R,5R,8R,9S,10S,13S,14S,17S)-17-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]oxane-2-carboxylic acid
Product Data
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Type
Bioactive small molecule
Product Format
Neat
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