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Home >> Chemical Listing >> Page 1189 >> 2-Hydroxy-1-[(3R,5S,8S,9S,10S,11S,13S,14S,17R)-3,11,17-Trihydroxy-10,13-Dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-Tetradecahydrocyclopenta[a]Phenanthren-17-Yl]Ethanone

2-Hydroxy-1-[(3R,5S,8S,9S,10S,11S,13S,14S,17R)-3,11,17-Trihydroxy-10,13-Dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-Tetradecahydrocyclopenta[a]Phenanthren-17-Yl]Ethanone
[CAS# 302-91-0]

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Identification
Name 2-Hydroxy-1-[(3R,5S,8S,9S,10S,11S,13S,14S,17R)-3,11,17-Trihydroxy-10,13-Dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-Tetradecahydrocyclopenta[a]Phenanthren-17-Yl]Ethanone
Synonyms .Alpha.-Thf; 3.Alpha.,5.Alpha.-Tetrahydrocortisol; 5.Alpha.-Pregnan-20-One, 3.Alpha.,11.Beta.,17,21-Tetrahydroxy-
Molecular Structure CAS#: 302-91-0, 2-Hydroxy-1-[(3R,5S,8S,9S,10S,11S,13S,14S,17R)-3,11,17-Trihydroxy-10,13-Dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-Tetradecahydrocyclopenta[a]Phenanthren-17-Yl]Ethanone
Molecular Formula C21H34O5
Molecular Weight 366.50
CAS Registry Number 302-91-0
EINECS 206-131-1
SMILES [C@@]14(C)[C@H]([C@H]2[C@H]([C@H](C1)O)[C@]3(C)[C@@H](CC2)C[C@@H](CC3)O)CC[C@@]4(C(CO)=O)O
InChI 1S/C21H34O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12-16,18,22-24,26H,3-11H2,1-2H3/t12-,13+,14-,15-,16-,18+,19-,20-,21-/m0/s1
InChIKey AODPIQQILQLWGS-FDSHTENPSA-N
Properties
Density 1.254g/cm3 (Cal.)
Boiling point 545.14°C at 760 mmHg (Cal.)
Flash point 297.555°C (Cal.)
Market Analysis Reports
List of Reports Available for 2-Hydroxy-1-[(3R,5S,8S,9S,10S,11S,13S,14S,17R)-3,11,17-Trihydroxy-10,13-Dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-Tetradecahydrocyclopenta[a]Phenanthren-17-Yl]Ethanone
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