Molecule

Eleganine A

AlkaPlorer ID: AK297357

Synonym: None

IUPAC Name: None

Structure

SMILES: C/C=C1/CN2C(OC)CC3=C(NC4=CC=CC=C34)C(=O)CC1C2C(=O)OC

InChI: InChI=1S/C21H24N2O4/c1-4-12-11-23-18(26-2)10-15-13-7-5-6-8-16(13)22-19(15)17(24)9-14(12)20(23)21(25)27-3/h4-8,14,18,20,22H,9-11H2,1-3H3/b12-4-

InChIKey: YTVBFWHIYAUPOK-QCDXTXTGSA-N

Reference

Induction of apoptosis in HuH-7 cancer cells by monoterpene and β-carboline indole alkaloids isolated from the leaves of Tabernaemontana elegans

PubChem CID: 172856501

CAS: 1181222-35-4

LOTUS: LTS0113065

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Tabernaemontana elegans	Tabernaemontana	Apocynaceae	Gentianales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 368.43300000000016

TPSA？: 71.63

MolLogP？: 2.689000000000001

Number of H-Donors: 1

Number of H-Acceptors: 5

RingCount: 4

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi