Produkty 2220-64-6

CAS 2220-64-6 to numer rejestracyjny substancji Allopregnanolone Impurity 1. Oferty producentów: Chemat Brand. Dostępne opakowania: on request.

Allopregnanolone Impurity 1
Chemat Brand
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  • Warianty: 1
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Wzór strukturalny: {0} (CAS {1})

(3S,5S,8R,9S,10S,13S,14S,16R,17S)-17-[(1S)-1-hydroxyethyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,16-diol (CAS 2220-64-6) to związek chemiczny o wzorze sumarycznym C21H36O3 i masie molowej 336.5 g/mol. Nazwa systematyczna IUPAC: (3S,5S,8R,9S,10S,13S,14S,16R,17S)-17-[(1S)-1-hydroxyethyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,16-diol. InChIKey: PYSDRYREDSFAKC-DTRVYOHYSA-N.

Dane identyfikacyjne
Wzór sumarycznyC21H36O3
Masa molowa336.5 g/mol
Nazwa IUPAC(3S,5S,8R,9S,10S,13S,14S,16R,17S)-17-[(1S)-1-hydroxyethyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,16-diol
InChIKeyPYSDRYREDSFAKC-DTRVYOHYSA-N
SMILESC[C@@H]([C@H]1[C@@H](C[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CC[C@@H](C4)O)C)C)O)O

Dane obliczone przez PubChem (NCBI)

Synonimy: Pregnane-3,16,20-triol, Allopregnanolone Impurity 1, Allopregnane-3beta,16alpha,20alpha-triol, (20S)-5alpha-Pregnane-3beta,16alpha,20-triol
Izomery (ten sam wzór sumaryczny)
ethyl 9-(3-methyl-5-pentylfuran-2-yl)nonanoate C21H36O3
2,4,6-tricyclohexyl-1,3,5-trioxane C21H36O3
(3S,5S,6S,8S,9S,10R,13S,14S,17S)-17-[(1R)-1-hydroxyethyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,6-diol C21H36O3
oxiran-2-ylmethyl (9Z,12Z)-octadeca-9,12-dienoate C21H36O3
oxiran-2-ylmethyl (9Z,12Z)-2,2,3,3,4-pentadeuteriooctadeca-9,12-dienoate C21H36O3
(3S,5S,8R,9S,10S,13S,14S,17S)-2-(hydroxymethyl)-10,13,17-trimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-3,17-diol C21H36O3
11-(3-methyl-5-pentylfuran-2-yl)undecanoic acid C21H36O3