None
AlkaPlorer ID: AK121567
Synonym: None
IUPAC Name: 1-[(9S,21R)-4-methoxy-2,12-diazahexacyclo[14.2.2.19,12.01,9.03,8.016,21]henicosa-3(8),4,6-trien-2-yl]ethanone
Structure
SMILES: COC1=CC=CC2=C1N(C(C)=O)[C@]13CC[C@@]4(CCCN5CC[C@@]21[C@H]54)CC3
InChI: InChI=1S/C22H28N2O2/c1-15(25)24-18-16(5-3-6-17(18)26-2)22-12-14-23-13-4-7-20(19(22)23)8-10-21(22,24)11-9-20/h3,5-6,19H,4,7-14H2,1-2H3/t19-,20-,21-,22+/m1/s1
InChIKey: PGRMOTGVMPDJPT-YSFYHYPLSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aspidosperma pyrifolium | Aspidosperma | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 352.4780000000001
TPSA？: 32.78
MolLogP？: 3.480400000000002
Number of H-Donors: 0
Number of H-Acceptors: 3
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|