100897-87-8

Basic information

• Product Name: (4S,4aR,6aS,6aS,6bR,8aS,10S,12aS,14bR)-4,10-dihydroxy-2,4a,6a,6b,9,9,1 2a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicen e-2-carboxylic acid
• Synonyms: (4S,4aR,6aS,6aS,6bR,8aS,10S,12aS,14bR)-4,10-dihydroxy-2,4a,6a,6b,9,9,1 2a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicen e-2-carboxylic acid
• CAS NO: 100897-87-8
• Molecular Formula: C30H48O4
• Molecular Weight: 472.69972
• Mol File: 100897-87-8.mol
• Article Data: 1

Chemical Properties

• Boiling Point: 584.1°Cat760mmHg
• Flash Point: 321.1°C
• Appearance: /
• Density: 1.14g/cm³
• Vapor Pressure: 4.48E-16mmHg at 25°C
• Refractive Index: 1.568
• CAS DataBase Reference: (4S,4aR,6aS,6aS,6bR,8aS,10S,12aS,14bR)-4,10-dihydroxy-2,4a,6a,6b,9,9,1 2a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicen e-2-carboxylic acid(CAS DataBase Reference)
• NIST Chemistry Reference: (4S,4aR,6aS,6aS,6bR,8aS,10S,12aS,14bR)-4,10-dihydroxy-2,4a,6a,6b,9,9,1 2a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicen e-2-carboxylic acid(100897-87-8)
• EPA Substance Registry System: (4S,4aR,6aS,6aS,6bR,8aS,10S,12aS,14bR)-4,10-dihydroxy-2,4a,6a,6b,9,9,1 2a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicen e-2-carboxylic acid(100897-87-8)

Safety Data

• Hazardous Substances Data: 100897-87-8(Hazardous Substances Data)

Usage

Definition

ChEBI: A pentacyclic triterpenoid with formula C30H48O4, originally isolated from Tripterygium hypoglaucum.

InChI:InChI=1/C30H48O4/c1-25(2)20-10-13-30(7)21(28(20,5)12-11-22(25)31)9-8-18-19-16-26(3,24(33)34)17-23(32)27(19,4)14-15-29(18,30)6/h8,19-23,31-32H,9-17H2,1-7H3,(H,33,34)/t19-,20-,21+,22-,23-,26?,27+,28-,29+,30+/m0/s1

Upstream product

• 84104-71-2 wilforlide A 

Relevant articles and documents

Isolation and Structure Elucidation of Abruslactone A: a New Oleanene-type Triterpene from the Roots and Vines of Abrus precatorius L.

Abruslactone A, a new triterpenoid sapogenin isolated from the roots and vines of Abrus precatorius L., has been characterized by spectral and X-ray analysis as the γ-lactone of 3β,22α-dihydroxy-olean-12-en-29α-oic acid, with ring E in an unusual boat conformation.