THDOC

cas: 567-02-2 — see every product listed under this CAS number, including other names

THDOC (CAS 567-02-2) is a chemical reagent available from Chemat. Available pack sizes: 10mg, 5mg. Offered by: GLPBio.

brandGLPBio
catalog numberGC45961-10
cas567-02-2
size10mg
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Available pack sizes

brand size price
GLPBio 10mg 2183.73 Pln
GLPBio 5mg 1509.74 Pln

properties

purityNo data
delivery timeTo be confirmed by Chemat
Structural formula: {0} (CAS {1})

5-alpha-THDOC is a 21-hydroxy steroid.

Source: ChEBI

Identity
Molecular formulaC21H34O3
Molecular weight334.5 g/mol
IUPAC name2-hydroxy-1-[(3R,5S,8R,9S,10S,13S,14S,17S)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone
InChIKeyCYKYBWRSLLXBOW-GDYGHMJCSA-N
SMILESC[C@]12CC[C@H](C[C@@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@@H]4C(=O)CO)C)O

Computed by PubChem (NCBI)

Synonyms: 3alpha,21-Dihydroxy-5alpha-pregnan-20-one, Allotetrahydrodeoxycorticosterone, 21-Hydroxyallopregnanolone, 5alpha-THDOC, 5-alpha-THDOC, 3|A,21-Dihydroxy-5|A-pregnan-20-one, 3alpha,21-dihydroxy-5alpha-pregnane-20-one, 3?,21-dihydroxy-5?-pregnan-20-one, 3beta,21-Dihydroxy-5alpha-pregnan-20-one, 3a,21-dihydroxy-5a-pregnan-20-one
Related forms of this compound
2-hydroxy-1-[(3S,5S,8R,9S,10S,13S,14S,17S)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone C21H34O3
Isomers (same molecular formula)
methyl (5Z,8Z)-10-[3-[(Z)-oct-2-enyl]oxiran-2-yl]deca-5,8-dienoate C21H34O3
methyl 4-[3-[(2Z,5Z,8Z)-tetradeca-2,5,8-trienyl]oxiran-2-yl]butanoate C21H34O3
methyl (6E,8Z,11Z,14Z)-5-hydroxyicosa-6,8,11,14-tetraenoate C21H34O3
1-[(3R,5R,8R,9S,10S,13S,14S,16R,17R)-3,16-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone C21H34O3
1-[(3R,5S,8S,9S,10S,11S,13S,14S,17S)-3,11-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone C21H34O3
1-[(3S,5S,6R,8R,9S,10R,13S,14S,17S)-3,6-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone C21H34O3
1-[(3R,5S,6S,8R,9S,10R,13S,14S,17S)-3,6-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone C21H34O3
1-[(3R,5S,8S,9S,10S,11R,13S,14S,17S)-3,11-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone C21H34O3
1-[(3R,8R,9S,10S,13R,14S,16R,17R)-3,16-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone C21H34O3
1-[(3S,5S,8R,9S,10S,13S,14S,16R,17R)-3,16-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone C21H34O3
(3S,5S,8R,9S,10S,13S,14S,17R)-2,10,13,17-tetramethyl-3,4,5,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,16,17-triol C21H34O3

Also listed as

3alpha,21-Dihydroxy-5alpha-pregnan-20-one TRC CAS 567-02-2
3α,21-Dihydroxy-5α-pregnan-20-one/ 98% TargetMol CAS 567-02-2
3α,21-Dihydroxy-5α-pregnan-20-one, 98.0% MedChemExpress CAS 567-02-2