Vobtusine Lactone
AlkaPlorer ID: AK321984
Synonym: None
IUPAC Name: methyl 24'-hydroxy-19'-methoxy-9'-oxospiro[15-oxa-8,19-diazahexacyclo[10.9.1.01,9.02,7.012,16.019,22]docosa-2,4,6,9-tetraene-17,15'-4,17-diazaheptacyclo[11.10.1.11,4.07,11.017,24.018,23.011,25]pentacosa-18(23),19,21-triene]-10-carboxylate
Structure
SMILES: COC(=O)C1=C2NC3=CC=CC=C3C23CCN2CC4(CC5CC67CC(=O)CC6CCN6CCC8(C9=CC=CC(OC)=C9N(C4)C58O)C67)C4OCCC4(C1)C23
InChI: InChI=1S/C44H50N4O6/c1-52-32-9-5-7-30-33(32)48-24-39(19-26-20-41-21-27(49)18-25(41)10-14-46-16-12-43(30,37(41)46)44(26,48)51)23-47-15-11-42-29-6-3-4-8-31(29)45-34(42)28(35(50)53-2)22-40(36(42)47)13-17-54-38(39)40/h3-9,25-26,36-38,45,51H,10-24H2,1-2H3
InChIKey: PWQNZSCRPVJZJK-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Voacanga globosa | Voacanga | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Tabernaemontana sphaerocarpa | Tabernaemontana | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 730.9060000000001
TPSA？: 103.81
MolLogP？: 4.352600000000003
Number of H-Donors: 2
Number of H-Acceptors: 10
RingCount: 13
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|