Basic information
- CAS
76983-01-2- Standard SMILES
CCOC(=O)c1cc(C(=O)OC2C[C@H]3CCN(C)[C@H]3[C@@H]3c4cc5c(cc4C(=O)O[C@@H]23)OCO5)c(C)nc1C- InChIKey
CIGBOXJOIYMZFE-XFDKXYDFSA-N- Molecular formula
- C28H30N2O8
- Average molar mass
- 522.5 g/mol
- Monoisotopic mass
- 522.20021592
Overview
Cliviamartine has been reported in Clivia miniata with data available.
Names & identifiers
- Preferred name
- Cliviamartine
- IUPAC
- 3-O-ethyl 5-O-[(2S,3R,7R,10R)-4-methyl-12-oxo-11,16,18-trioxa-4-azapentacyclo[11.7.0.02,10.03,7.015,19]icosa-1(20),13,15(19)-trien-9-yl] 2,6-dimethylpyridine-3,5-dicarboxylate
Names & synonyms
Cliviamartine76983-01-2Lycorenan-7-one, 5-(((5-(ethoxycarbonyl)-2,6-dimethyl-3-pyridinyl)carbonyl)oxy)-4,12-dihydro-1-methyl-9,10-(methylenebis(oxy))-,5alpha,12beta,13beta)-
Database identifiers
- CAS
76983-01-2- PubChem CID
- 129010900
- ChEMBL
CHEMBL448553
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 6
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 946
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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