Reserpine; (-)-form, Stereoisomer, O17-de-Me
AlkaPlorer ID: AK096634
Synonym: Neonorreserpine
IUPAC Name: methyl 18-hydroxy-6-methoxy-17-(3,4,5-trimethoxybenzoyl)oxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate
Structure
SMILES: COC(=O)C1C(O)C(OC(=O)C2=CC(OC)=C(OC)C(OC)=C2)CC2CN3CCC4=C(NC5=CC(OC)=CC=C45)C3CC21
InChI: InChI=1S/C32H38N2O9/c1-38-18-6-7-19-20-8-9-34-15-17-12-24(43-31(36)16-10-25(39-2)30(41-4)26(11-16)40-3)29(35)27(32(37)42-5)21(17)14-23(34)28(20)33-22(19)13-18/h6-7,10-11,13,17,21,23-24,27,29,33,35H,8-9,12,14-15H2,1-5H3
InChIKey: DNXIKVLOVZVMQF-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Yunnanensis | Phaeosphaeriaceae | Pleosporales | Dothideomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 594.6610000000003
TPSA？: 128.78
MolLogP？: 3.517000000000002
Number of H-Donors: 2
Number of H-Acceptors: 10
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|