1-[(4R,14R,19R,21R)-9,14-dihydroxy-8-methoxy-15-oxa-1,11-diazahexacyclo[16.3.1.0⁴,¹².0⁴,²¹.0⁵,¹⁰.0¹³,¹⁹]docosa-5(10),6,8,12,17-pentaen-11-yl]ethanone
AlkaPlorer ID: AK151643
Synonym: None
IUPAC Name: 1-[(4R,14R,19R,21R)-9,14-dihydroxy-8-methoxy-15-oxa-1,11-diazahexacyclo[16.3.1.04,12.04,21.05,10.013,19]docosa-5(10),6,8,12,17-pentaen-11-yl]ethanone
Structure
SMILES: COC1=CC=C2C(=C1O)N(C(C)=O)C1=C3[C@@H]4C[C@H]5N(CC[C@@]125)CC4=CCO[C@H]3O
InChI: InChI=1S/C22H24N2O5/c1-11(25)24-18-14(3-4-15(28-2)19(18)26)22-6-7-23-10-12-5-8-29-21(27)17(20(22)24)13(12)9-16(22)23/h3-5,13,16,21,26-27H,6-10H2,1-2H3/t13-,16-,21-,22-/m1/s1
InChIKey: QNRXUPPYOATRSF-ZQZWAHKHSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Strychnos henningsii | Strychnos | Loganiaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 396.4430000000002
TPSA？: 82.47000000000001
MolLogP？: 1.642
Number of H-Donors: 2
Number of H-Acceptors: 6
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|