Basic information
- Standard SMILES
CCOC(=O)C1=CC2(CC)CCCN3CCc4c(n1c1ccccc41)C32- InChIKey
DDNCQMVWWZOMLN-UHFFFAOYSA-N- Molecular formula
- C22H26N2O2
- Average molar mass
- 350.5 g/mol
- Monoisotopic mass
- 350.19942808
Overview
LSM-1372 is an alkaloid.
Names & identifiers
- Preferred name
- Ethyl eburnamenine-14-carboxylate
- IUPAC
- ethyl 15-ethyl-1,11-diazapentacyclo[9.6.2.02,7.08,18.015,19]nonadeca-2,4,6,8(18),16-pentaene-17-carboxylate
Names & synonyms
Ethyl eburnamenine-14-carboxylateDTXSID90860599ethyl 15-ethyl-1,11-diazapentacyclo[9.6.2.02,7.08,18.015,19]nonadeca-2,4,6,8(18),16-pentaene-17-carboxylateethyl 15-ethyl-1,11-diazapentacyclo(9.6.2.02,7.08,18.015,19)nonadeca-2,4,6,8(18),16-pentaene-17-carboxylateRefChem:1085037DTXCID50209349Ethyl apovincaminate(3alpha,16alpha)-Eburnamenine-14-carboxylic acid ethyl esterEburnamenine-14-carboxylic acid, ethyl ester, (3.alpha.,16.alpha.)-Eburnamenine-14-carboxylic acid, ethyl esterMLS006011923orb1310877
Show more names
SCHEMBL7947532BDBM86220CHEBI:91571DDNCQMVWWZOMLN-UHFFFAOYSA-NHMS3266B06HMS5087B17ALBB-022444LSM-1372
Database identifiers
- PubChem CID
- 5673
- DTXSID
DTXSID90860599- ChEBI
CHEBI:91571
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 34.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 617
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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