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15-Deacetylneosolaniol

15-Deacetylneosolaniol structure

CAS No:
76348-84-0
Formula:
C17H24O7
Chemical Name:
15-Deacetylneosolaniol
Synonyms:
Trichothec-9-ene-3,4,8,15-tetrol,12,13-epoxy-,4-acetate,(3α,4β,8α)-;Toxin NT 2;15-Deacetylneosolaniol;4-Acetoxy T-2 tetraol;MHT 2;97373-19-8

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Description

3,8,15-Trihydroxy-12,13-epoxytrichothec-9-en-4-yl acetate is a trichothecene.

15-Deacetylneosolaniol Basic Attributes

Molecular Weight：

340.4 g/mol

Exact Mass：

340.37

Characteristics

PSA：

109 Å²

Melting Point：

163-164 °C

Drug Information

MeSH Entry Terms：

4 beta-acetoxy-12,13-epoxytrichothec-9-ene-3 alpha,8 alpha,15 triol

Computed Properties

Molecular Weight:340.4
XLogP3:-1.5
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:3
Exact Mass:340.15220310
Monoisotopic Mass:340.15220310
Topological Polar Surface Area:109
Heavy Atom Count:24
Complexity:618
Defined Atom Stereocenter Count:7
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 15-Deacetylneosolaniol

Description
Basic Attributes
Characteristics
Drug Information
Computed Properties

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