Ophiorine A
AlkaPlorer ID: AK462442
Synonym: None
IUPAC Name: 17-ethenyl-18-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-19-oxa-2,12-diazapentacyclo[14.3.1.02,14.05,13.06,11]icosa-3,5,7,9,11,13-hexaene-20-carboxylic acid
Structure
SMILES: C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC2C(C(=O)O)C1CC1=C3N=C4C=CC=CC4=C3C=CN12
InChI: InChI=1S/C26H28N2O9/c1-2-11-14-9-16-19-13(12-5-3-4-6-15(12)27-19)7-8-28(16)23(18(14)24(33)34)36-25(11)37-26-22(32)21(31)20(30)17(10-29)35-26/h2-8,11,14,17-18,20-23,25-26,29-32H,1,9-10H2,(H,33,34)
InChIKey: MYJKHRHLAAMOED-UHFFFAOYSA-N
Reference
Glucoindole alkaloids from bark of two Sickingia species
PubChem CID: 163192292
LOTUS: LTS0080790
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Ophiorrhiza japonica | Ophiorrhiza | Rubiaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 512.5150000000002
TPSA？: 163.73000000000002
MolLogP？: 0.4878000000000007
Number of H-Donors: 5
Number of H-Acceptors: 10
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|