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Solanidine

Solanidine structure

CAS No:
80-78-4
Formula:
C27H43NO
Chemical Name:
Solanidine
Synonyms:
Solanid-5-en-3-ol,(3β)-;Solanid-5-en-3β-ol;Solanidine;1H-Naphth[2′,1′:4,5]indeno[1,2-b]indolizine,solanid-5-en-3-ol deriv.;(3β)-Solanid-5-en-3-ol;Solatubine;Solanidin;Solatubin;NSC 76025;(-)-Solanidine;11031-61-1
Categories:
Biochemical Engineering > Chinese Herbs

Description

Solanidine is a cholestane alkaloid isolated from several potato species including Solanum demissum, Solanum acaule, and Solanum tuberosum. Solanidine can inhibit proliferation and exhibit obvious antitumor effect[1].

Solid

Solanidine is a steroid alkaloid fundamental parent, an alkaloid, an organic heterohexacyclic compound and a 3beta-hydroxy-Delta(5)-steroid. It has a role as a plant metabolite and a toxin. It is a conjugate base of a solanidine(1+).

Solanidine Basic Attributes

Molecular Weight：

397.64

Exact Mass：

397.64

EC Number：

201-309-5

UNII：

W7801OHM8B

NSC Number：

76025

Characteristics

PSA：

23.5

XLogP3：

5.372

Appearance：

Solid

Density：

1.1g/cm3

Melting Point：

218.5 °C

Boiling Point：

503.1ºC at 760 mmHg

Flash Point：

223.5ºC

Refractive Index：

1.576

Water Solubility：

0.01976 mg/L @ 25 °C (est)

Storage Conditions：

2-8°C

Specific rotation：

D21 -29° (c = 0.5 in chloroform)

Safety Information

Packing level：

III

Hazard category：

6.1(b)

Transport codes：

1544

wgk germany：

hazard class code：

23/24/25-53-22

safety instructions：

2-13-45-36/37/39-22

RTECS Number：

WF0500000

Marks：

T+,Xn

Precautionary statement(s)：

P261, P264, P270, P271, P273, P280, P301+P310, P301+P312, P302+P352, P304+P340, P311, P312, P321, P322, P330, P361, P363, P403+P233, P405, P501

Hazard Statements：

H301

GHS Classification：

|Warning|H302 (92.68%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P273, P301+P312, P330, and P501|Aggregated GHS information provided by 41 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

solanidine

Solanidine Use and Manufacturing

Use Classification：

Lipids -> Sterol Lipids [ST] -> Sterols [ST01] -> Solanidines and alkaloid derivatives [ST0115]

Computed Properties

Molecular Weight:397.6
XLogP3:6.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Exact Mass:397.334464995
Monoisotopic Mass:397.334464995
Topological Polar Surface Area:23.5
Heavy Atom Count:29
Complexity:715
Defined Atom Stereocenter Count:11
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Solanidine

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties
Learn More Other Chemicals

Solanidine

SDS

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