Products 2687960-83-2

CAS 2687960-83-2 appears in our catalog under these names: Pregnanetriol–d4, Pregnanetriol-d4, 99.84%. Offered by: GLPBio, MedChemExpress. Available pack sizes: 1mg, 1 mg.

Pregnanetriol–d4
GLPBio
  • size: 1mg
  • Variants: 1
from 2604.97
View product
Pregnanetriol-d4, 99.84%
MedChemExpress
  • size: 1 mg
  • Variants: 1
from 3189.68
View product
Structural formula: {0} (CAS {1})

(3R,5R,8R,9S,10S,13S,14S,17R)-10,13-dimethyl-17-[(1S)-1,2,2,2-tetradeuterio-1-hydroxyethyl]-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-3,17-diol (CAS 2687960-83-2) is a chemical compound with the molecular formula C21H36O3 and a molecular weight of 340.5 g/mol. IUPAC name: (3R,5R,8R,9S,10S,13S,14S,17R)-10,13-dimethyl-17-[(1S)-1,2,2,2-tetradeuterio-1-hydroxyethyl]-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-3,17-diol. InChIKey: SCPADBBISMMJAW-QQGSCTBASA-N.

Identity
Molecular formulaC21H36O3
Molecular weight340.5 g/mol
IUPAC name(3R,5R,8R,9S,10S,13S,14S,17R)-10,13-dimethyl-17-[(1S)-1,2,2,2-tetradeuterio-1-hydroxyethyl]-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-3,17-diol
InChIKeySCPADBBISMMJAW-QQGSCTBASA-N
SMILES[2H][C@@]([C@]1(CC[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)(C([2H])([2H])[2H])O

Computed by PubChem (NCBI)

Synonyms: Pregnanetriol-d4
Related forms of this compound
(3R,5R,8R,9S,10S,13S,14S,17R)-17-[(1S)-1-hydroxyethyl]-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-3,17-diol C21H36O3
(3R,5R,8R,9S,10S,13S,14S,17R)-17-[(1R)-1-hydroxyethyl]-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-3,17-diol C21H36O3
(3S,5S,8R,9S,10S,13S,14S,17R)-17-[(1S)-1-hydroxyethyl]-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-3,17-diol C21H36O3
(3S,8R,9S,10S,13S,14S,17R)-17-[(1S)-1-hydroxyethyl]-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-3,17-diol C21H36O3
Isomers (same molecular formula)
(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 C21H36O3
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