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(1S)-1α-(β-D-Glucopyranosyloxy)-1,4a,5,7aα-tetrahydro-4aα-hydroxy-7-(hydroxymethyl)cyclopenta[c]pyran-4-carboxylic acid methyl ester

(1S)-1α-(β-D-Glucopyranosyloxy)-1,4a,5,7aα-tetrahydro-4aα-hydroxy-7-(hydroxymethyl)cyclopenta[c]pyran-4-carboxylic acid methyl ester structure

CAS No:
23407-76-3
Formula:
C17H24O11
Chemical Name:
(1S)-1α-(β-D-Glucopyranosyloxy)-1,4a,5,7aα-tetrahydro-4aα-hydroxy-7-(hydroxymethyl)cyclopenta[c]pyran-4-carboxylic acid methyl ester
Synonyms:
(1S)-1α-(β-D-Glucopyranosyloxy)-1,4a,5,7aα-tetrahydro-4aα-hydroxy-7-(hydroxymethyl)cyclopenta[c]pyran-4-carboxylic acid methyl ester;Theviridoside
Categories:
Natural Products > Iridoid Derivatives

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Description

Theviridoside is a natural iridoid glucoside found in the leaves of Cerbera odollam, it has cytotoxicity.

(1S)-1α-(β-D-Glucopyranosyloxy)-1,4a,5,7aα-tetrahydro-4aα-hydroxy-7-(hydroxymethyl)cyclopenta[c]pyran-4-carboxylic acid methyl ester Basic Attributes

Molecular Weight：

404.36586

Exact Mass：

404.131866

Characteristics

PSA：

175.37000

XLogP3：

-2.13

Density：

1.6±0.1 g/cm3

Boiling Point：

690.2±55.0 °C at 760 mmHg

Flash Point：

248.6±25.0 °C

Refractive Index：

1.644

Drug Information

MeSH Entry Terms：

theviridoside

Computed Properties

Molecular Weight:404.4
XLogP3:-2.9
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:6
Exact Mass:404.13186158
Monoisotopic Mass:404.13186158
Topological Polar Surface Area:175
Heavy Atom Count:28
Complexity:662
Defined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (1S)-1α-(β-D-Glucopyranosyloxy)-1,4a,5,7aα-tetrahydro-4aα-hydroxy-7-(hydroxymethyl)cyclopenta[c]pyran-4-carboxylic acid methyl ester

Description
Basic Attributes
Characteristics
Drug Information
Computed Properties
Learn More Other Chemicals

(1S)-1α-(β-D-Glucopyranosyloxy)-1,4a,5,7aα-tetrahydro-4aα-hydroxy-7-(hydroxymethyl)cyclopenta[c]pyran-4-carboxylic acid methyl ester

SDS

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