HYPOTHEMYCIN structure

HYPOTHEMYCIN

2,3,16-trihydroxy-18-methoxy-12-methyl-6,13-dioxatricyclo[13.4.0.05,7]nonadeca-1(15),9,16,18-tetraene-8,14-dione

Also Known As: HYPOTHEMYCIN|2,3,16-trihydroxy-18-methoxy-12-methyl-6,13-dioxatricyclo[13.4.0.0?,?]nonadeca-1(19),9,15,17-tetraene-8,14-dione

CAS: 76958-67-3
Molecular Formula C19H22O8
Molecular Weight 378.13147 g/mol
LogP 1.4
Topological Polar Surface Area 126.0 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 8
Rotatable Bonds 1
Exact Mass 378.13147
Monoisotopic Mass 378.13147
Heavy Atoms 27
Complexity 590.0

Chemical Identifiers

CAS Number 76958-67-3
SMILES CC1CC=CC(=O)C2C(O2)CC(C(C3=C(C(=CC(=C3)OC)O)C(=O)O1)O)O
InChIKey HDZUUVQEDFZKAX-UHFFFAOYSA-N

Product Overview

HYPOTHEMYCIN (CAS 76958-67-3), with molecular formula C19H22O8 and molecular weight 378.13147 g/mol. IUPAC: 2,3,16-trihydroxy-18-methoxy-12-methyl-6,13-dioxatricyclo[13.4.0.05,7]nonadeca-1(15),9,16,18-tetraene-8,14-dione.

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