delta 5-Pregnenetriol

(3S,8R,9S,10R,13S,14S,17R)-17-[(1S)-1-hydroxyethyl]-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,17-diol

Also Known As: delta 5-Pregnenetriol|(3b,20S)-Pregn-5-ene-3,17,20-triol|Pregn-5-en-3,17,20-triol|Pregn-5-ene-3,17,20-triol|Pregn-5-ene-3b,17,20a-triol|Pregn-5-ene-3b,17a,20a-triol|(3|A,20S)-Pregn-5-ene-3,17,20-triol|Pregn-5-ene-3beta,17alpha,20S-triol|NP6195|Pregn-5-ene-3|A,17|A,20|A-triol|TN5310|5-Pregnene-3beta,17alpha,20alpha-triol|Pregn-5-ene-3|A,17,20|A-triol|Pregn-5-ene-3beta,17alpha,20alpha-triol|5-Pregnen-3-beta,17,20-alpha-triol|5-pregnene-3 beta,17 alpha,20 alpha-triol|Pregn-5-ene-3??,17??,20S-triol|(3beta,20S)-pregn-5-ene-3,17,20-triol|SID:163563887|(20S)-Pregn-5-ene-3beta,17,20-triol|(20S)-Pregn-5-ene-3beta,17alpha,20-triol|(3|A,20R)-Pregn-5-ene-3,17,20-triol|pregn-5-ene-3 beta,17 alpha,20 alpha-triol|(3S,8R,9S,10R,13S,14S,17R)-17-[(1S)-1-hydroxyethyl]-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,17-diol| currency5-Pregnene-3|A,17|A,20(S)-triol|Pregn-5-ene-3,17,20-triol, (3beta,20S)-|(3b,17a,20S)-Pregn-5-ene-3,17,20-triol|3-BETA,17-ALPHA,20-ALPHA-TRIHYDROXY-5-PREGNENE|(3|A,17|A,20S)-Pregn-5-ene-3,17,20-triol|(3beta,17alpha,20S)-Pregn-5-ene-3,17,20-triol|5-pregnene-3 beta,17 alpha,20 alpha-triol, (3beta)-isomer|5-pregnene-3 beta,17 alpha,20 alpha-triol, (3beta,20beta)-isomer|(1R,3aS,3bR,7S,9aR,9bS,11aS)-1-[(1S)-1-hydroxyethyl]-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-1,7-diol|(3S,8R,9S,10R,13S,14S,17R)-17-((1S)-1-hydroxyethyl)-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta(a)phenanthrene-3,17-diol

Molecular Formula	C21H34O3
Molecular Weight	334.2508 g/mol
LogP	3.1
Topological Polar Surface Area	60.7 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	3
Rotatable Bonds	1
Exact Mass	334.2508
Monoisotopic Mass	334.2508
Heavy Atoms	24
Complexity	557.0

Chemical Identifiers

CAS Number	2204-13-9
SMILES	C[C@@H]([C@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C)O)O
InChIKey	XGUQCUDPXSTKLI-PUOFRWEFSA-N