Stigmasterol glucoside

Stigmasterol glucoside
Compound Structure:
Synonyms: Stigmasterol glucoside; 19716-26-8 ;stigmasterol 3-O-beta-D-glucoside ;Poriferasterol monoglucoside ;CHEMBL447335
Compound ID: NMPC-1507
PubChem ID:

6602508
Molecular Formula: C35H58O6
Canonical SMILES: CCC(C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C
InChIKey: VWDLOXMZIGUBKM-AUGXRQBFSA-N
About the compound:
Properties:

Chemical and Physical Properties

Computed Properties

Property Name

Property Value

Molecular Weight

574.8 g/mol

XLogP3-AA

7

Hydrogen Bond Donor Count

4

Hydrogen Bond Acceptor Count

6

Rotatable Bond Count

8

Exact Mass

574.42333957 g/mol

Monoisotopic Mass

574.42333957 g/mol

Topological Polar Surface Area

99.4Ų

Heavy Atom Count

41

Formal Charge

0

Complexity

962

Isotope Atom Count

0

Defined Atom Stereocenter Count

14

Undefined Atom Stereocenter Count

0

Defined Bond Stereocenter Count

1

Undefined Bond Stereocenter Count

0

Covalently-Bonded Unit Count

1

Compound Is Canonicalized

Yes

Physical Description

Solid

Boiling Point

 

Melting Point

299 °C

Source:PubChem
Source Species: Eremomastax speciosa
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