11,19R-Dihydroxytabersonine
AlkaPlorer ID: AK042741
Synonym: ''
IUPAC Name: methyl (1R,12S,19R)-5-hydroxy-12-[(1R)-1-hydroxyethyl]-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2(7),3,5,9,13-pentaene-10-carboxylate
Structure
SMILES: COC(=O)C1=C2NC3=CC(O)=CC=C3[C@@]23CCN2CC=C[C@@]([C@@H](C)O)(C1)[C@H]23
InChI: InChI=1S/C21H24N2O4/c1-12(24)20-6-3-8-23-9-7-21(19(20)23)15-5-4-13(25)10-16(15)22-17(21)14(11-20)18(26)27-2/h3-6,10,12,19,22,24-25H,7-9,11H2,1-2H3/t12-,19+,20+,21+/m1/s1
InChIKey: PWAHHGUORQEYOW-DDEZQWHHSA-N
Reference
Alkaloids from Melodinus hemsleyanus
PubChem CID: 15137437
LOTUS: LTS0041604
SuperNatural Ⅲ: SN0296618-01
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Melodinus suaveolens | Melodinus | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 368.4330000000001
TPSA？: 82.03
MolLogP？: 1.8976
Number of H-Donors: 3
Number of H-Acceptors: 6
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|