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Home >> Chemical Listing >> Page 181 >> (20R)-5beta-Pregnane-3alpha,17,20-Triol

(20R)-5beta-Pregnane-3alpha,17,20-Triol
[CAS# 1165-28-2]

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Identification
Name (20R)-5beta-Pregnane-3alpha,17,20-Triol
Molecular Structure CAS#: 1165-28-2, (20R)-5beta-Pregnane-3alpha,17,20-Triol
Molecular Formula C21H36O3
Molecular Weight 336.51
CAS Registry Number 1165-28-2
EINECS 214-614-3
SMILES [C@@]14(C)[C@H]([C@H]2[C@H](CC1)[C@]3(C)[C@H](CC2)C[C@@H](CC3)O)CC[C@@]4([C@@H](C)O)O
InChI 1S/C21H36O3/c1-13(22)21(24)11-8-18-16-5-4-14-12-15(23)6-9-19(14,2)17(16)7-10-20(18,21)3/h13-18,22-24H,4-12H2,1-3H3/t13-,14-,15-,16-,17+,18+,19+,20+,21+/m1/s1
InChIKey SCPADBBISMMJAW-OYMMSLOLSA-N
Properties
Density 1.123g/cm3 (Cal.)
Boiling point 469.9°C at 760 mmHg (Cal.)
Flash point 208.194°C (Cal.)
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