Niveusin C structure

Niveusin C

[(1R,2Z,4R,8R,9R,11R,12S)-1,12-dihydroxy-2,11-dimethyl-7-methylidene-6-oxo-5,14-dioxatricyclo[9.2.1.04,8]tetradec-2-en-9-yl] (Z)-2-methylbut-2-enoate

Also Known As: Niveusin C|1-epi-Niveusin C|[(1R,2Z,4R,8R,9R,11R,12S)-1,12-dihydroxy-2,11-dimethyl-7-methylidene-6-oxo-5,14-dioxatricyclo[9.2.1.04,8]tetradec-2-en-9-yl] (Z)-2-methylbut-2-enoate|(1R,2Z,4R,8R,9R,11R,12S)-1,12-dihydroxy-2,11-dimethyl-7-methylidene-6-oxo-5,14-dioxatricyclo[9.2.1.04,8]tetradec-2-en-9-yl (2Z)-2-methylbut-2-enoate|(Z)-2-Methyl-2-butenoic acid [(3aR,4R,6R,7S,9R,10Z,11aR)-2,3,3a,4,5,6,7,8,9,11a-decahydro-7,9-dihydroxy-6,10-dimethyl-3-methylene-2-oxo-6,9-epoxycyclodeca[b]furan-4-yl] ester

CAS: 75680-27-2
Molecular Formula C20H26O7
Molecular Weight 378.16785 g/mol
LogP 1.5407
Topological Polar Surface Area 102.29 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 7
Rotatable Bonds 2
Exact Mass 378.16785
Monoisotopic Mass 378.16785
Heavy Atoms 27
Complexity 751.4292

Chemical Identifiers

CAS Number 75680-27-2
SMILES C/C=C(/C)\C(=O)O[C@@H]1C[C@@]2([C@H](C[C@@](O2)(/C(=C\[C@@H]3[C@@H]1C(=C)C(=O)O3)/C)O)O)C

Product Overview

Niveusin C (CAS 75680-27-2), with molecular formula C20H26O7 and molecular weight 378.16785 g/mol. IUPAC: [(1R,2Z,4R,8R,9R,11R,12S)-1,12-dihydroxy-2,11-dimethyl-7-methylidene-6-oxo-5,14-dioxatricyclo[9.2.1.04,8]tetradec-2-en-9-yl] (Z)-2-methylbut-2-enoate.

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