Trichotheca-9,12-dien-8-one, 3,7,15-trihydroxy-, (3a,7a)-


Chemical Name: Trichotheca-9,12-dien-8-one, 3,7,15-trihydroxy-, (3a,7a)-
CAS Number: 88054-24-4
Product Number: AG00GTH8(AGN-PC-0VINVW)
Synonyms:
MDL No:
Molecular Formula: C15H20O5
Molecular Weight: 280.3163

Identification/Properties


Computed Properties
Molecular Weight:
280.32g/mol
XLogP3:
0
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
280.131g/mol
Monoisotopic Mass:
280.131g/mol
Topological Polar Surface Area:
87A^2
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
524
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
6
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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