None
AlkaPlorer ID: AK553314
Synonym: None
IUPAC Name: methyl (1S,11R,13R,15S,16S,18S)-15-ethyl-19-oxa-9,17-diazahexacyclo[15.2.1.02,10.03,8.011,16.013,18]icosa-2(10),3,5,7-tetraene-11-carboxylate
Structure
SMILES: CC[C@H]1C[C@@H]2C[C@]3(C(=O)OC)C4=C(C5=CC=CC=C5N4)[C@H]4CN([C@@H]13)[C@H]2O4
InChI: InChI=1S/C21H24N2O3/c1-3-11-8-12-9-21(20(24)25-2)17-16(13-6-4-5-7-14(13)22-17)15-10-23(18(11)21)19(12)26-15/h4-7,11-12,15,18-19,22H,3,8-10H2,1-2H3/t11-,12+,15+,18-,19-,21-/m0/s1
InChIKey: VWACLRDKXRAKLQ-YURUDGLDSA-N
Reference
Alkaloids from leaves and stem bark of Ervatamia polyneura
PubChem CID: 102239678
LOTUS: LTS0190138
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Tabernaemontana peduncularis | Tabernaemontana | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 352.434
TPSA？: 54.56
MolLogP？: 3.110100000000001
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|