19-methoxy-12-oxa-8,17-diazaheptacyclo[15.5.2.0¹,¹?.0²,?.0?,²².0¹¹,²¹.0¹?,²?]tetracosa-2,4,6,14-tetraen-9-one
AlkaPlorer ID: AK124886
Synonym: None
IUPAC Name: (8aS,13aS)-5-methoxy-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-14-one
Structure
SMILES: COC1C2C3=CCOC4CC(=O)N5C6=CC=CC=C6[C@@]6(CCN(C3)C16)[C@@H]5C42
InChI: InChI=1S/C22H24N2O3/c1-26-19-17-12-6-9-27-15-10-16(25)24-14-5-3-2-4-13(14)22(20(24)18(15)17)7-8-23(11-12)21(19)22/h2-6,15,17-21H,7-11H2,1H3/t15?,17?,18?,19?,20-,21?,22-/m0/s1
InChIKey: JASVNTDJKFETNC-IYGIIMLPSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Urtica dioica | Urtica | Urticaceae | Rosales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Strychnos ignatii | Strychnos | Loganiaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 364.44500000000016
TPSA？: 42.010000000000005
MolLogP？: 1.7174
Number of H-Donors: 0
Number of H-Acceptors: 4
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|