[2-[(5S,8S,9S,10S,11S,13S,14S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 3,3-dimethylbutanoate
-
![[2-[(5S,8S,9S,10S,11S,13S,14S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 3,3-dimethylbutanoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/8a1f65fa5f2d497682f49b1a3f9e66e5.png "[2-[(5S,8S,9S,10S,11S,13S,14S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 3,3-dimethylbutanoate")
[2-[(5S,8S,9S,10S,11S,13S,14S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 3,3-dimethylbutanoate
structure -
-
CAS No:
5936-24-3
-
Formula:
C27H42O6
-
Chemical Name:
[2-[(5S,8S,9S,10S,11S,13S,14S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 3,3-dimethylbutanoate
-
Synonyms:
NSC15485;Hydrallostane 21-tert-butylacetate;NSC-15485;5.alpha.-Pregnane-3, 11.beta.,17,21-trihydroxy-, 21-(3,3-dimethylbutyrate);Pregnane-3, 21-[(3,3-dimethyl-1-oxobutyl)oxy]-11,17-dihydroxy-, (5.alpha.,11.beta.)-;5936-24-3
-
CAS No:
[2-[(5S,8S,9S,10S,11S,13S,14S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 3,3-dimethylbutanoate Basic Attributes
462.6 g/mol
462.29813906 g/mol
15485
Computed Properties
Molecular Weight:462.6
XLogP3:3.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:462.29813906
Monoisotopic Mass:462.29813906
Topological Polar Surface Area:101
Heavy Atom Count:33
Complexity:829
Defined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Learn More Other Chemicals
-
Chloromethyl 3,3-dimethylbutanoate
114670-75-6
-
1-Methylethyl 3,3-dimethylbutanoate
60498-66-0
-
tert-butyl 3,3-dimethylbutanoate
69341-75-9
-
[2-(2,5-dimethoxyanilino)-2-oxoethyl] 3,3-dimethylbutanoate Formula
380193-86-2
-
[2-[2-morpholin-4-yl-5-(trifluoromethyl)anilino]-2-oxoethyl] 3,3-dimethylbutanoate Formula
380179-77-1
-
[2-(3-bromoanilino)-2-oxoethyl] 3,3-dimethylbutanoate Formula
380202-99-3
-
[2-(3-bromophenyl)-2-oxoethyl] 3,3-dimethylbutanoate Structure
437731-35-6
-
[2-(3-chloro-4-cyanoanilino)-2-oxoethyl] 3,3-dimethylbutanoate Structure
744244-69-7
-
What is [2-[(1S,2S,4S,8S,9S,11S,13S,19S)-12,19-difluoro-11-hydroxy-6,6,9,13-tetramethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-8-yl]-2-oxoethyl] 3,3-dimethylbutanoate
38965-31-0
-
What is [2-[(5-tert-butyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl] 3,3-dimethylbutanoate
956359-09-4
Request for Quotation