3α-Acetoxy-20-oxo-29-norlupane-23,28-dioic acid

Inquiry

For Research Use Only.

Category

Terpenes

Cat.No.

NP6484

CAS

262272-76-4

Product Name

3α-Acetoxy-20-oxo-29-norlupane-23,28-dioic acid

Structure

Product Details

Description

3α-Acetoxy-20-oxo
-29-norlupane-23,28-dioic acid isolated from the leaves of Brassaiopsis glomerulata.

Synonyms

(1R,3aS,5aR,5bR,7aR,8S,9R,11aR,11bR,13aR,13bS)-9-acetoxy-1-acetyl-5a,5b,8,11a-tetramethylicosahydro-3aH-cyclopenta[a]chrysene-3a,8-dicarboxylic acid

IUPAC Name

(1R,3aS,5aR,5bR,7aR,8S,9R,11aR,11bR,13aR,13bS)-1-acetyl-9-acetyloxy-5a,5b,8,11a-tetramethyl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a,8-dicarboxylic acid

Molecular Weight

530.7

Molecular Formula

C31H46O7

Canonical SMILES

CC(=O)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C(=O)O)OC(=O)C)C)C(=O)O

InChI

InChI=1S/C31H46O7/c1-17(32)19-9-14-31(26(36)37)16-15-28(4)20(24(19)31)7-8-21-27(3)12-11-23(38-18(2)33)30(6,25(34)35)22(27)10-13-29(21,28)5/h19-24H,7-16H2,1-6H3,(H,34,35)(H,36,37)/t19-,20+,21+,22+,23+,24+,27+,28+,29+,30-,31-/m0/s1

Boiling Point

641.5±40.0 °C(Predicted)

Purity

> 95%

Density

1.22±0.1 g/cm3(Predicted)

Appearance

Powder

pKa

4.30±0.70(Predicted)

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