Dehydroaglaiastatin

Inquiry

For Research Use Only.

Category

Alkaloids

Cat.No.

NP0232

CAS

155595-93-0

Product Name

Dehydroaglaiastatin

Structure

Product Details

Description

Dehydroaglaiastatin is an alkaloid isolated from Aglaia odorata Lour.

Synonyms

Dehydroaglaiastatin; 155595-93-0; C31H28N2O6; (2S,10R,11R)-2-hydroxy-4,6-dimethoxy-10-(4-methoxyphenyl)-11-phenyl-9-oxa-14,19-diazapentacyclo[10.7.0.02,10.03,8.014,18]nonadeca-1(12),3(8),4,6,18-pentaen-13-one; CHEMBL466993

IUPAC Name

(2S,10R,11R)-2-hydroxy-4,6-dimethoxy-10-(4-methoxyphenyl)-11-phenyl-9-oxa-14,19-diazapentacyclo[10.7.0.02,10.03,8.014,18]nonadeca-1(12),3(8),4,6,18-pentaen-13-one

Molecular Weight

524.573

Molecular Formula

C31H28N2O6

Canonical SMILES

COC1=CC=C(C=C1)C23C(C4=C(C2(C5=C(C=C(C=C5O3)OC)OC)O)N=C6CCCN6C4=O)C7=CC=CC=C7

InChI

InChI=1S/C31H28N2O6/c1-36-20-13-11-19(12-14-20)31-26(18-8-5-4-6-9-18)25-28(32-24-10-7-15-33(24)29(25)34)30(31,35)27-22(38-3)16-21(37-2)17-23(27)39-31/h4-6,8-9,11-14,16-17,26,35H,7,10,15H2,1-3H3/t26-,30+,31+/m1/s1

InChIKey

YCIPQJTZJGUXND-JZRGNDHQSA-N

Boiling Point

681.2±65.0°C (Predicted)

Purity

98.0%

Density

1.39±0.1 g/cm3(Predicted)

Appearance

Powder

Form

Powder

pKa

12.39±0.60(Predicted)

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