Vobtusamine
AlkaPlorer ID: AK262658
Synonym: None
IUPAC Name: methyl 3,24'-dihydroxy-19'-methoxyspiro[18-oxa-4,14-diazahexacyclo[9.9.2.01,17.04,22.05,10.014,21]docosa-5,7,9,11(22)-tetraene-16,15'-8-oxa-4,17-diazaheptacyclo[11.10.1.11,4.07,11.017,24.018,23.011,25]pentacosa-18(23),19,21-triene]-3-carboxylate
Structure
SMILES: COC(=O)C1(O)CC23CCOC2C2(CC4CC56CCOC5CCN5CCC7(C8=CC=CC(OC)=C8N(C2)C47O)C56)CN2CCC4=C(C23)N1C1=CC=CC=C41
InChI: InChI=1S/C43H50N4O7/c1-51-30-9-5-7-28-33(30)46-24-38(20-25-21-39-13-18-53-31(39)11-16-44-17-12-41(28,35(39)44)43(25,46)50)23-45-15-10-27-26-6-3-4-8-29(26)47-32(27)34(45)40(14-19-54-36(38)40)22-42(47,49)37(48)52-2/h3-9,25,31,34-36,49-50H,10-24H2,1-2H3
InChIKey: SNCVQFPLUXCDRF-UHFFFAOYSA-N
Reference
Vobtusamine, the first spiro Aspidosperma-Eburnea alkaloid
PubChem CID: 73801823
LOTUS: LTS0019597
COCONUT: CNP0105952
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Voacanga chalotiana | Voacanga | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 734.894
TPSA？: 109.1
MolLogP？: 3.6697000000000015
Number of H-Donors: 2
Number of H-Acceptors: 11
RingCount: 13
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|