4-Cholesten-3-one-[4-13C]

Datasheet MSDS
Catalog Number
ALP2595
Product Name
4-Cholesten-3-one-[4-13C]
Structure
4-Cholesten-3-one-[4-13C]
CAS Number
68165-57-1
IUPAC Name
(8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
Synonyms
4-Cholesten-3-one-4-13C; Δ4-Cholesten-3-one-4-13C; (+)-4-Cholesten-3-one-4-13C; (17β)-17-Octylandrost-4-en-3-one-4-13C; 3-Oxocholest-4-ene-4-13C; Δ4-Cholestenone-4-13C; 4-Cholestenone-4-13C; Cholesterone-4-13C; NSC134926-4-13C
Molecular Formula
C26[13C]H44O
Molecular Weight
385.65
Appearance
Off-White Solid
Purity
98%;99% atom 13C
SMILES
C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=[13CH]C(=O)CC[C@]34C)C
InChI
InChI=1S/C27H44O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h17-19,22-25H,6-16H2,1-5H3/t19-,22+,23-,24+,25+,26+,27-/m1/s1/i17+1
InChI Key
NYOXRYYXRWJDKP-HLMQNULZSA-N
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