3-O-cis-p-Coumaroylmaslinic acid

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For Research Use Only.

Category

Triterpenoids

Cat.No.

NP7176

CAS

69297-40-1

Product Name

3-O-cis-p-Coumaroylmaslinic acid

Structure

Product Details

Description

3-O-cis-p-Coumaroylmaslinic acid is a triterpenoid compound found in Licania heteromorpha, Tetracera boiviniana, and Leptospermum scoparium.

Synonyms

3-cis-Coumaroylmaslinic acid; 3-beta-O-(cis-p-Coumaroyl)maslinic acid; (2α,3β)-2-Hydroxy-3-{[(2Z)-3-(4-hydroxyphenyl)-2-propenoyl]oxy}olean-12-en-28-oic acid; Olean-12-en-28-oic acid, 2-hydroxy-3-[[(2Z)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-, (2α,3β)-

IUPAC Name

(4aS,6aR,6aS,6bR,8aR,10R,11R,12aR,14bS)-11-hydroxy-10-[(Z)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid

Molecular Weight

618.86

Molecular Formula

C39H54O6

Canonical SMILES

CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)OC(=O)C=CC6=CC=C(C=C6)O)O)C)C)C2C1)C)C(=O)O)C

InChI

InChI=1S/C39H54O6/c1-34(2)18-20-39(33(43)44)21-19-37(6)26(27(39)22-34)13-14-30-36(5)23-28(41)32(35(3,4)29(36)16-17-38(30,37)7)45-31(42)15-10-24-8-11-25(40)12-9-24/h8-13,15,27-30,32,40-41H,14,16-23H2,1-7H3,(H,43,44)/b15-10-/t27-,28+,29-,30+,32-,36-,37+,38+,39-/m0/s1

InChIKey

KWLOAKAXMOYBRK-JHXZZHGESA-N

Boiling Point

715.6±60.0°C (Predicted)

Melting Point

278-282°C

Purity

≥95%

Density

1.20±0.1 g/cm3 (Predicted)

Solubility

Soluble in Acetone, Chloroform, Dichloromethane, DMSO, Ethyl Acetate

Appearance

Powder

Storage

Store at -20°C

Form

Powder

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