Reserpic acid; O-(2-Acetamido-4,5-dimethoxybenzoyl), Me ester
AlkaPlorer ID: AK186115
Synonym: Dimethoxyanthraserpine
IUPAC Name: methyl 17-(2-acetamido-4,5-dimethoxybenzoyl)oxy-6,18-dimethoxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate
Structure
SMILES: COC(=O)C1C2CC3C4=C(CCN3CC2CC(OC(=O)C2=CC(OC)=C(OC)C=C2NC(C)=O)C1OC)C1=CC=C(OC)C=C1N4
InChI: InChI=1S/C34H41N3O9/c1-17(38)35-25-15-28(43-4)27(42-3)14-23(25)33(39)46-29-11-18-16-37-10-9-21-20-8-7-19(41-2)12-24(20)36-31(21)26(37)13-22(18)30(32(29)44-5)34(40)45-6/h7-8,12,14-15,18,22,26,29-30,32,36H,9-11,13,16H2,1-6H3,(H,35,38)
InChIKey: QTWPFDIUDLMBHD-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Catharanthus trichophyllus | Catharanthus | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 635.7140000000002
TPSA？: 137.65
MolLogP？: 4.120900000000002
Number of H-Donors: 2
Number of H-Acceptors: 10
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|