[17-[(E)-N-hydroxy-C-methylcarbonimidoyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate

Base Information

Chemical Name:[17-[(E)-N-hydroxy-C-methylcarbonimidoyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
CAS No.:17916-30-2
Molecular Formula:C23H35 N O3
Molecular Weight:373.536
Hs Code.:
European Community (EC) Number:241-859-3
NSC Number:86004
Mol file:17916-30-2.mol

Synonyms:[17-[(E)-N-hydroxy-C-methylcarbonimidoyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate;17916-30-2;3beta-Hydroxypregn-5-en-20-one oxime 3-acetate;SCHEMBL17432756;NSC86004;NSC-86004;AKOS000621306;AKOS016303523;F3161-0238;(E)-17-(1-(hydroxyimino)ethyl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl acetate

Suppliers and Price of [17-[(E)-N-hydroxy-C-methylcarbonimidoyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 6 raw suppliers

Chemical Property of [17-[(E)-N-hydroxy-C-methylcarbonimidoyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate

Chemical Property:

Boiling Point:494.2oC at 760 mmHg
Flash Point:252.7oC
PSA：58.89000
Density:1.23g/cm3
LogP:5.34720
XLogP3:5.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:373.26169398
Heavy Atom Count:27
Complexity:683

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=NO)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)C)C)C
Isomeric SMILES:C/C(=N\O)/C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)C)C)C

Technology Process of [17-[(E)-N-hydroxy-C-methylcarbonimidoyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate

There total 8 articles about [17-[(E)-N-hydroxy-C-methylcarbonimidoyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 88.0%

: 1778-02-5
Pregnenolone acetate

: 17916-30-2
3β-acetoxy-20-hydroxyimino-5-pregnene

Guidance literature:: With hydroxylamine hydrochloride; triethylamine; In pyridine; for 6h; Reflux;
DOI:10.1007/s10600-008-9051-x

Reference yield:

: 77-60-1
tigogenin

: 17916-30-2
3β-acetoxy-20-hydroxyimino-5-pregnene

Guidance literature:: Multistep reaction;
DOI:10.1023/A:1012503015119

Reference yield:

: 145-13-1
Pregnenolone

: 17916-30-2
3β-acetoxy-20-hydroxyimino-5-pregnene

Guidance literature:: Multi-step reaction with 2 steps

1: pyridine / 24 h / 20 °C

2: sodium acetate; hydroxylamine hydrochloride / ethanol / 2 h / 60 °C

With pyridine; hydroxylamine hydrochloride; sodium acetate; In ethanol;
DOI:10.3390/molecules18077436