UB_AYI_002.1
AlkaPlorer ID: AK010087
Synonym: 'ConMedNP.1137'
IUPAC Name: (1S,22R,23R,24S)-15-methoxy-4-methyl-9-oxa-4,13-diazahexacyclo[11.6.5.01,24.06,22.010,23.014,19]tetracosa-6,10,14(19),15,17-pentaene-12,20-dione
Structure
SMILES: COC1=C2C(=CC=C1)[C@@]13CCN(C)CC4=CCOC5=CC(=O)N2[C@H]1[C@H]5[C@H]4CC3=O
InChI: InChI=1S/C23H24N2O4/c1-24-8-7-23-15-4-3-5-16(28-2)21(15)25-19(27)11-17-20(22(23)25)14(10-18(23)26)13(12-24)6-9-29-17/h3-6,11,14,20,22H,7-10,12H2,1-2H3/t14-,20-,22-,23+/m0/s1
InChIKey: BWCDHPDWBTWWLO-USDOHBJKSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Strychnos icaja | Strychnos | Loganiaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 392.4550000000001
TPSA？: 59.080000000000005
MolLogP？: 2.043
Number of H-Donors: 0
Number of H-Acceptors: 5
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|