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Product Overview

Product Code

CDX-00001759

CAS Number

27215-14-1

Product Format

Single Solution

Molecular Formula

C26 H40 O8

Molecular Weight

480.59

Product Categories

Terpenes

Documentation

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Product Information

Analyte Data

Analyte Name

Neo-Andrographolide

CAS Number

27215-14-1

Molecular Formula

C26 H40 O8

Molecular Weight

480.59

Accurate Mass

480.2723

Melting Point

167-168

Appearance/Form

Solid

Color

White

Odor

Odourless

SMILES

C[C@@]1(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)CCC[C@@]3(C)[C@H](CCC4=CCOC4=O)C(=C)CC[C@H]13

InChI

InChI=1S/C26H40O8/c1-15-5-8-19-25(2,14-33-24-22(30)21(29)20(28)18(13-27)34-24)10-4-11-26(19,3)17(15)7-6-16-9-12-32-23(16)31/h9,17-22,24,27-30H,1,4-8,10-14H2,2-3H3/t17-,18-,19-,20-,21+,22-,24-,25+,26+/m1/s1

IUPAC

4-[2-[(1R,4aS,5R,8aS)-5,8a-dimethyl-2-methylidene-5-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2H-furan-5-one

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

UNITED STATES

Product Format

Single Solution

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