2-Aminobenzoic acid; N-Docosanoyl, Et ester
AlkaPlorer ID: AK085249
Synonym: Ethyl N-docosanoylanthranilate
IUPAC Name: ethyl 2-(docosanoylamino)benzoate
Structure
SMILES: CCCCCCCCCCCCCCCCCCCCCC(=O)NC1=CC=CC=C1C(=O)OCC
InChI: InChI=1S/C31H53NO3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-27-30(33)32-29-26-24-23-25-28(29)31(34)35-4-2/h23-26H,3-22,27H2,1-2H3,(H,32,33)
InChIKey: ZCKYIMVVSFEAIM-UHFFFAOYSA-N
Reference
Secoiridoid glycosides and an antifungal anthranilate derivative from Gentiana tibetica
PubChem CID: 5317244
CAS: 209523-04-6
LOTUS: LTS0157954
SuperNatural Ⅲ: SN0466656
NPASS: NPC124841
COCONUT: CNP0267846
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Gentiana tibetica | Gentiana | Gentianaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Crataegus pinnatifida | Crataegus | Rosaceae | Rosales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 487.7690000000002
TPSA？: 55.400000000000006
MolLogP？: 9.6237
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|