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CAS

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65027-01-2

(22S)-16,28-Secosolanid-5-ene-3β,16α-diol is a steroidal alkaloid that occurs in the extract of Veratrum grandiflorum. It crystallizes from Me2CO as colorless plates and is laevorotatory with a specific rotation of [α]D 35.8° (c 1.19, CHCl3).

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  • 65027-01-2 Structure

  • Basic information

    1. Product Name: (22S)-16,28-Secosolanid-5-ene-3β,16α-diol
    2. Synonyms: (22S)-16,28-Secosolanid-5-ene-3β,16α-diol;Teinemine
    3. CAS NO:65027-01-2
    4. Molecular Formula: C27H45NO2
    5. Molecular Weight: 415.6517
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 65027-01-2.mol

  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 544.2°C at 760 mmHg
    3. Flash Point: 59°C
    4. Appearance: /
    5. Density: 1.09g/cm3
    6. Vapor Pressure: 4.09E-14mmHg at 25°C
    7. Refractive Index: 1.563
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. CAS DataBase Reference: (22S)-16,28-Secosolanid-5-ene-3β,16α-diol(CAS DataBase Reference)
    11. NIST Chemistry Reference: (22S)-16,28-Secosolanid-5-ene-3β,16α-diol(65027-01-2)
    12. EPA Substance Registry System: (22S)-16,28-Secosolanid-5-ene-3β,16α-diol(65027-01-2)

  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 65027-01-2(Hazardous Substances Data)

65027-01-2 Usage

Uses

Used in Pharmaceutical Industry:
(22S)-16,28-Secosolanid-5-ene-3β,16α-diol is used as a pharmaceutical compound for its potential therapeutic properties. Its steroidal alkaloid structure may contribute to its bioactivity and efficacy in treating various health conditions.
Used in Research Applications:
(22S)-16,28-Secosolanid-5-ene-3β,16α-diol is used as a research compound for studying its chemical properties, structure, and potential applications in drug development. Its unique structure and biological activity make it an interesting subject for scientific investigation.

Check Digit Verification of cas no

The CAS Registry Mumber 65027-01-2 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 6,5,0,2 and 7 respectively; the second part has 2 digits, 0 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 65027-01:
(7*6)+(6*5)+(5*0)+(4*2)+(3*7)+(2*0)+(1*1)=102
102 % 10 = 2
So 65027-01-2 is a valid CAS Registry Number.
InChI:InChI=1/C27H45NO2/c1-16-5-8-23(28-15-16)17(2)25-24(30)14-22-20-7-6-18-13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4/h6,16-17,19-25,28-30H,5,7-15H2,1-4H3/t16-,17+,19-,20+,21-,22-,23+,24+,25-,26-,27-/m0/s1

65027-01-2SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 18, 2017

Revision Date: Aug 18, 2017

1.Identification

1.1 GHS Product identifier

Product name deacetylmuldamine

1.2 Other means of identification

Product number -
Other names Teinemine

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:65027-01-2 SDS

65027-01-2Relevant articles and documents

STRUCTURE OF THE STEROIDAL ALKALOID MULDAMINE AND ITS DEACETYL DERIVATIVE

Gaffield, William,Wong, Rosalind Y.,Lundin, Robert E.,Keeler, Richard F.

, p. 2397 - 2400 (1982)

Spectral techniques have established the structure of muldamine from Veratrum californicum as (22S,25S)-22,26-epiminocholest-5-ene-3β,16α-diol 16-acetate, instead of the C-nor-D-homo steroid structure previously suggested.Its deacetyl derivative seems to be identical with teinemine, the configuration of which at C-22 is therefore S and not R as previously reported.Key Word Index-Veratrum californicum; Liliaceae; steroidal alkaloid; muldamine; (22S,25S)-22,26-epiminocholest-5-ene-3β,16α-diol 16-acetate; deacetylmuldamine; teinemine; isoteinemine.

Partial Synthesis of the Steroid Alkaloids Teinemine, 22-Isoteinemine, Etioline, and 25-Isoetioline

Quyen, Le thi,Ripperger, Helmut,Schreiber, Klaus

, p. 143 - 149 (2007/10/02)

The rare 16α-hydroxylated steroid alkaloids teinemine , 22-isoteinemine , etioline , and 25-isoetioline are synthesized from the abundant spirosolane alkaloids tomatid-5-en-3β-ol and solasodine , respectively.The crucial stages of these syntheses are the conversion of 1 or 15 into the N-protected (22S,25S)-, (22R,25S)-, and (22S,25R) -22,26-epimino-3β-hydroxycholest-5-en-16-ones 6, 7, and 18 as well as their reductions with sodium/2-propanol to the 16α-hydroxy compounds teinemine (8), 22-isoteinemine (10), and (22S,25R)-22,26-epiminocholest-5-ene-3β,16α-diol (19), respectively.By treatment with sodium methanolate the N-chloro derivatives 9 and 11 of 8 and 10 afford etioline (12).In an analogous manner, the N-chloro derivative 20 of 19 is converted into 25-isoetioline (21).

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