 Home > Encyclopedia > (1S,2R,3S,5S,7R,9R,10R,11S,12S)-3,10,11-trihydroxy-2-(hydroxymethyl)-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodecane-12,2'-oxirane]-4-one

(1S,2R,3S,5S,7R,9R,10R,11S,12S)-3,10,11-trihydroxy-2-(hydroxymethyl)-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodecane-12,2'-oxirane]-4-one

(1S,2R,3S,5S,7R,9R,10R,11S,12S)-3,10,11-trihydroxy-2-(hydroxymethyl)-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodecane-12,2'-oxirane]-4-one structure

CAS No:
24393-94-0
Formula:
C15H22O7
Chemical Name:
(1S,2R,3S,5S,7R,9R,10R,11S,12S)-3,10,11-trihydroxy-2-(hydroxymethyl)-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodecane-12,2'-oxirane]-4-one
Synonyms:
Dihydronivalenol;24393-94-0;Trichothecan-8-one, 12,13-epoxy-3-alpha,4-beta,7-alpha,15-tetrahydroxy-;DTXSID00947264;3,4,7,15-Tetrahydroxy-12,13-epoxytrichothecan-8-one

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(1S,2R,3S,5S,7R,9R,10R,11S,12S)-3,10,11-trihydroxy-2-(hydroxymethyl)-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodecane-12,2'-oxirane]-4-one Basic Attributes

Molecular Weight：

314.33 g/mol

Exact Mass：

314.13655304 g/mol

Characteristics

PSA：

120 Å²

Computed Properties

Molecular Weight:314.33
XLogP3:-1.5
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:1
Exact Mass:314.13655304
Monoisotopic Mass:314.13655304
Topological Polar Surface Area:120
Heavy Atom Count:22
Complexity:538
Defined Atom Stereocenter Count:9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (1S,2R,3S,5S,7R,9R,10R,11S,12S)-3,10,11-trihydroxy-2-(hydroxymethyl)-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodecane-12,2'-oxirane]-4-one

Basic Attributes
Characteristics
Computed Properties

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