DEOXYNIVALENOL

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

CAS: 51481-10-8

Molecular Formula	`C15H20O6`
Molecular Weight	296.31 g/mol
LogP	-0.7
Topological Polar Surface Area	99.5 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	6
Rotatable Bonds	1
Exact Mass	296.12598
Heavy Atoms	21
Complexity	558.0

Chemical Identifiers

CAS Number	51481-10-8
SMILES	`CC1=CC2C(C(C1=O)O)(C3(CC(C(C34CO4)O2)O)C)CO`
InChIKey	`LINOMUASTDIRTM-QGRHZQQGSA-N`

📖 Product Overview

DEOXYNIVALENOL (CAS: 51481-10-8) is a chemical compound with molecular formula C15H20O6 and molecular weight 296.31 g/mol. Its IUPAC systematic name is (1R,2R,3S,7R,9R,10R,12S)-3,10-dihydroxy-2-(hydroxymethyl)-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-4-one. LogP -0.7 Topological Polar Surface Area 99.5 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 6 Rotatable Bonds 1 Exact Mass 296.12598 Heavy Atoms 21 Complexity 558.0 InChI Key: LINOMUASTDIRTM-QGRHZQQGSA-N. SMILES: CC1=CC2C(C(C1=O)O)(C3(CC(C(C34CO4)O2)O)C)CO.

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