Peyonine
AlkaPlorer ID: AK002250
Synonym: None
IUPAC Name: 1-[2-(3,4,5-trimethoxyphenyl)ethyl]pyrrole-2-carboxylic acid
Structure
SMILES: COC1=CC(=CC(=C1OC)OC)CCN2C=CC=C2C(=O)O
InChI: InChI=1S/C16H19NO5/c1-20-13-9-11(10-14(21-2)15(13)22-3)6-8-17-7-4-5-12(17)16(18)19/h4-5,7,9-10H,6,8H2,1-3H3,(H,18,19)
InChIKey: DDYNENGLSGKEPO-UHFFFAOYSA-N
Reference
Chapter 6 Alkaloids Unclassified and of Unknown Structure
PubChem CID: 602258
CAS: 19717-25-0
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|
Properties Information
Molecule Weight: 305.33000000000004
TPSA？: 69.92
MolLogP？: 2.4547999999999996
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Phaseolus vulgaris | Phaseolus vulgaris | Inhibition | 0.0 | % | 10.1021/np50013a017 |