(6aS,11S,12aS,12bR)-11-methyl-1,2,3,5,6,6a,10,11,12a,12b-decahydrochromeno[2,3-g]indolizin-12-one
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Basic information
- CAS
28230-65-1- Standard SMILES
C[C@H]1CC=CC2=C1C(=O)[C@@H]1[C@H](CCN3CCC[C@H]13)O2- InChIKey
RETGXUCYBMOWOH-WJNVRWDZSA-N- Molecular formula
- C16H21NO2
- Average molar mass
- 259.34 g/mol
- Monoisotopic mass
- 259.15722891
Overview
24-methylene-24-dihydroparkeol has been reported in Elaeocarpus angustifolius and Elaeocarpus sphaericus with data available.
Names & identifiers
- Preferred name
- (6aS,11S,12aS,12bR)-11-methyl-1,2,3,5,6,6a,10,11,12a,12b-decahydrochromeno[2,3-g]indolizin-12-one
- IUPAC
- (6aS,11S,12aS,12bR)-11-methyl-1,2,3,5,6,6a,10,11,12a,12b-decahydrochromeno[2,3-g]indolizin-12-one
- English name
- (7β,8α,16α)-15,16-Dihydroeleocarpine
- Molecular formula
- C16H21NO2
- Molecular weight
- 259.34344
Names & synonyms
Epialloeleocarpiline(7β,8α,16α)-15,16-Dihydroeleocarpine
Database identifiers
- CAS
28230-65-1- PubChem CID
- 101593039
- Nikkaji
- J37.123H
Properties
Computed structural propertiesFilling in
- XLogP
- 2.2
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 479
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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