6-O-((2'',4''-Di-O-Acetyl-3''-O-trans-Cinnamoyl)-alpha-L-Rhamnopyranosyl)Catalpol
[CAS# 148000-43-5]

Identification

• Name: 6-O-((2'',4''-Di-O-Acetyl-3''-O-trans-Cinnamoyl)-alpha-L-Rhamnopyranosyl)Catalpol
• Synonyms: Scropolioside D; Beta-D-Glucopyranoside, 6-((2,4-Di-O-Acetyl-6-Deoxy-3-O-(1-Oxo-3-Phenyl-2-Propenyl)-Alpha-L-Mannopyranosyl)Oxy)-1A,1B,2,5A,6,6A-Hexahydro-1A-(Hydroxymethyl)Oxireno(4,5)Cyclopenta(1,2-C)Pyran-2-Yl, (1As-(1Aalpha,1Bbeta,2Beta,5Abeta,6Beta(E),6Aalpha))-
• Molecular Formula: C₃₄H₄₂O₁₇
• Molecular Weight: 722.70
• CAS Registry Number: 148000-43-5
• SMILES: C6=C(/C=C/C(OC1C(OC(=O)C)C(OC(C1OC(=O)C)C)OC2C4C(C3(C2O3)CO)C(OC=C4)OC5OC(C(C(C5O)O)O)CO)=O)C=CC=C6
• InChI: 1S/C34H42O17/c1-15-26(45-16(2)37)28(48-21(39)10-9-18-7-5-4-6-8-18)29(46-17(3)38)33(44-15)49-27-19-11-12-43-31(22(19)34(14-36)30(27)51-34)50-32-25(42)24(41)23(40)20(13-35)47-32/h4-12,15,19-20,22-33,35-36,40-42H,13-14H2,1-3H3/b10-9+
• InChIKey: XTDOKCBBQODVJW-MDZDMXLPSA-N

Properties

• Density: 1.514g/cm³ (Cal.)
• Boiling point: 837.473°C at 760 mmHg (Cal.)
• Flash point: 259.896°C (Cal.)