(3S)-17-[(E)-5-ethyl-6-methylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

Base Information Edit

Chemical Name:(3S)-17-[(E)-5-ethyl-6-methylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
CAS No.:83-48-7
Molecular Formula:C29H48O
Molecular Weight:412.7
Hs Code.:29309070
Mol file:83-48-7.mol

Synonyms:Stigmasta-5,22-dien-3-ol, (3.beta.,22E)-;Stigmasta-5,22-dien-3.beta.-ol;5,22-Cholestadien-24-ethyl-3.beta.-ol;Stigmasta-5,22-dien-3-ol, (3.beta.)-;(22E)-Stigmasta-5,22-dien-3.beta.-ol #;HCXVJBMSMIARIN-WWUFFIEYSA-N

Suppliers and Price of (3S)-17-[(E)-5-ethyl-6-methylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

Supply Marketing:Edit

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

Usbiological
Stigmasterol
25g
$ 322.00

TRC
Stigmasterol
1g
$ 55.00

TCI Chemical
Stigmasterol >90.0%(GC)
25g
$ 271.00

TCI Chemical
Stigmasterol >90.0%(GC)
5g
$ 111.00

TCI Chemical
Stigmasterol >90.0%(GC)
1g
$ 41.00

Sigma-Aldrich
Stigmasterol ~95%
25g
$ 706.00

Sigma-Aldrich
Stigmasterol certified reference material, 10?mg/mL in chloroform
1 mL
$ 44.00

Sigma-Aldrich
Stigmasterol certified reference material, 10 mg/mL in chloroform
47132
$ 42.60

Sigma-Aldrich
Stigmasterol ~95%
1g
$ 51.60

Sigma-Aldrich
Stigmasterol ~95%
5g
$ 202.00

Total 132 raw suppliers

Chemical Property of (3S)-17-[(E)-5-ethyl-6-methylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol Edit

Chemical Property:

Appearance/Colour:White solid
Vapor Pressure:9.21E-10mmHg at 25°C
Melting Point:161-170 °C
Refractive Index:1.504
Boiling Point:501.1 °C at 760 mmHg
PKA:15.03±0.70(Predicted)
Flash Point:219.4 °C
PSA：20.23000
Density:0.98 g/cm³
LogP:7.80080
Storage Temp.:0-6°C
Solubility.:chloroform: soluble50 mg/ml
Water Solubility.:insoluble
XLogP3:8.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:5
Exact Mass:412.370516150
Heavy Atom Count:30
Complexity:674

Purity/Quality:

95% up ^*data from raw suppliers

Stigmasterol ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xn,Xi
Hazard Codes:Xn,Xi
Statements: 22-38-40-48/20/22-36/37/38-67-36/38-20-63
Safety Statements: 22-24/25-36/37-36-26

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:CCC(C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C
Isomeric SMILES:CCC(/C=C/C(C)C1CCC2C1(CCC3C2CC=C4C3(CC[C@@H](C4)O)C)C)C(C)C
Description Stigmasterol is a kind of plant sterol or phytosterol. It is a kind of steroid derivative containing the hydroxyl group, unsaturated bonds, and alkyl group. It mainly exists in the fats and oils of soybean, Calabar bean, and rape seed as well as some kinds of vegetables, legumes and nuts. It can be used for the manufacture of semisynthetic progesterone which is a valuable human hormone. It can also be used in the biosynthesis of androgen, estrogen, and corticoids. Moreover, it can be used for the manufacture of vitamin D3 and cortisone. As a dietary supplement, it can reduce the cholesterol contained in the human body, thus boosting the health state of our body. Stigmasterol is a natural plant sterol that can be isolated from certain seed oils and herbs, including those used for therapeutic purposes. Dietary consumption of phytosterols, including stigmasterol, may have beneficial health effects in adults, particularly against cancer and ulceration. Alternatively, phytosterols may contribute to inflammation and intestinal failure-associated liver disease in young individuals.
Uses Plant sterol, used as a precursor in the synthesis of progesterone. Stigmasterol has been used as a phytosterol compound to test its anti-proliferative property in breast cancer cell culture and its effect on liver X receptor-α (LXRA) activation. It may be used as an internal standard for the quantification of yeast cell wall sterols using gas chromatography–mass spectrometry (GC-MS) analysis, and in the preparation of lipid monolayers.

Technology Process of (3S)-17-[(E)-5-ethyl-6-methylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

There total 24 articles about (3S)-17-[(E)-5-ethyl-6-methylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol 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: 96.0%