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α-Spinasterol

α-Spinasterol structure

CAS No:
481-18-5
Formula:
C29H48O
Chemical Name:
α-Spinasterol
Synonyms:
Stigmasta-7,22-dien-3-ol,(3β,5α,22E)-;5α-Stigmasta-7,22-dien-3β-ol,(E)-;5α-Stigmasta-7,22-dien-3β-ol;(3β,5α,22E)-Stigmasta-7,22-dien-3-ol;Bessisterol;Hitodesterol;α-Spinasterin;Spinasterol;α-Spinasterol;Δ7,22-Stigmastan-3β-ol;Stigmasta-7,22-dien-3β-ol;27638-79-5
Categories:
Biochemical Engineering > Chinese Herbs

Description

α-Spinasterol, isolated from Spinacia oleracea, has antibacterial activity[1]. α-Spinasterol is a transient receptor potential vanilloid 1 (TRPV1) antagonist, has anti-inflammatory, antidepressant, antioxidant and antinociceptive effects. α-Spinasterol inhibits COX-1 andCOX-2 activities with IC50 values of 16.17 μM and 7.76 μM, respectively[2].

Alpha-Spinasterol is a steroid. It derives from a hydride of a stigmastane.

α-Spinasterol Basic Attributes

Molecular Weight：

412.69

Exact Mass：

412.69

UNII：

0LG993QX1A

Characteristics

PSA：

20.2

XLogP3：

10.13

Density：

1.0±0.1 g/cm3

Melting Point：

168-169 °C

Boiling Point：

500.0±44.0 °C at 760 mmHg

Flash Point：

219.1±20.7 °C

Refractive Index：

1.531

Vapor Pressure：

4.31E-12mmHg at 25°C

Specific rotation：

D25 -3.6° (c = 2.8 in chloroform)

Drug Information

MeSH Entry Terms：

alpha-spinasterol

α-Spinasterol Use and Manufacturing

Uses

α-Spinasterol was identified as a novel transient receptor potential vanilloid 1 antagonist with antinociceptive properties.

Use Classification：

Lipids -> Sterol Lipids [ST] -> Sterols [ST01] -> Stigmasterols and C24-ethyl derivatives [ST0104]

Computed Properties

Molecular Weight:412.7
XLogP3:8.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:5
Exact Mass:412.370516150
Monoisotopic Mass:412.370516150
Topological Polar Surface Area:20.2
Heavy Atom Count:30
Complexity:674
Defined Atom Stereocenter Count:9
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 481-18-5

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Guide of α-Spinasterol

Description
Basic Attributes
Characteristics
Drug Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
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α-Spinasterol

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