Vitepyrroloid A; 3β-Acetoxy, N-(3-carboxypropyl)
AlkaPlorer ID: AK317791
Synonym: Vitepyrroloid C
IUPAC Name: None
Structure
SMILES: CC(=O)OC1CCC2(C)C(CCC(C)C2(O)CCC2=C(C#N)N(CCCC(=O)O)C=C2)C1(C)C
InChI: InChI=1S/C27H40N2O5/c1-18-8-9-22-25(3,4)23(34-19(2)30)11-13-26(22,5)27(18,33)14-10-20-12-16-29(21(20)17-28)15-6-7-24(31)32/h12,16,18,22-23,33H,6-11,13-15H2,1-5H3,(H,31,32)
InChIKey: REQOGKCAIWGQHB-UHFFFAOYSA-N
Reference
CAS: 2097488-18-9
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Vitex trifolia | Vitex | Lamiaceae | Lamiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 472.6260000000003
TPSA？: 112.55
MolLogP？: 4.692380000000004
Number of H-Donors: 2
Number of H-Acceptors: 6
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|