Reserpic acid; O-(2-Acetamidobenzoyl), Me ester
AlkaPlorer ID: AK262478
Synonym: Anthraserpine
IUPAC Name: methyl 17-(2-acetamidobenzoyl)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=CC=C2NC(C)=O)C1OC)C1=CC=C(OC)C=C1N4
InChI: InChI=1S/C32H37N3O7/c1-17(36)33-24-8-6-5-7-22(24)31(37)42-27-13-18-16-35-12-11-21-20-10-9-19(39-2)14-25(20)34-29(21)26(35)15-23(18)28(30(27)40-3)32(38)41-4/h5-10,14,18,23,26-28,30,34H,11-13,15-16H2,1-4H3,(H,33,36)
InChIKey: JIFVMTQVZQNMCX-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Catharanthus trichophyllus | Catharanthus | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 575.6620000000001
TPSA？: 119.19
MolLogP？: 4.103700000000003
Number of H-Donors: 2
Number of H-Acceptors: 8
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|