5Alpha-Pregnane-3Beta,6Alpha,20Beta-triol-6-O-Beta-D-glucuronide
Product Specifications
Synonyms
(2S,3S,4S,5R)-3,4,5-Trihydroxy-6-(((3S,5S,6S,8S,9S,10R,13S,14S,17S)-3-hydroxy-17-((S)-1-hydroxyethyl)-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-6-yl)oxy)tetrahydro-2H-pyran-2-carboxylic Acid
Hazard Statement
No Data Available
Purity
>95% (HPLC)
Smiles
O[C@@H](C)[C@H]1CC[C@@]2([H])[C@]3([H])C[C@H](OC4[C@H](O)[C@@H](O)[C@H](O)[C@@H](C(O)=O)O4)[C@@]5([H])C[C@@H](O)CC[C@]5(C)[C@@]3([H])CC[C@]12C
Molecular Formula
C27H44O9
Molecular Weight
512.64
InChI
InChI=1S/C27H44O9/c1-12(28)15-4-5-16-14-11-19(35-25-22(32)20(30)21(31)23(36-25)24(33)34)18-10-13(29)6-8-27(18,3)17(14)7-9-26(15,16)2/h12-23,25,28-32H,4-11H2,1-3H3,(H,33,34)/t12-,13-,14-,15+,16-,17-,18+,19-,20-,21-,22+,23-,25?,26+,27+/m0/s1
Additionnal Information
IUPAC name: (2S,3S,4S,5R)-3,4,5-trihydroxy-6-(((3S,5S,6S,8S,9S,10R,13S,14S,17S)-3-hydroxy-17-((S)-1-hydroxyethyl)-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-6-yl)oxy)tetrahydro-2H-pyran-2-carboxylic acid
Shipping Conditions
Room Temperature
Storage Conditions
+4°C
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