Martinelline; Parent acid
AlkaPlorer ID: AK305277
Synonym: Martinellic acid
IUPAC Name: 1-[N'-(3-methylbut-2-enyl)carbamimidoyl]-4-[3-[[N'-(3-methylbut-2-enyl)carbamimidoyl]amino]propyl]-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinoline-8-carboxylic acid
Structure
SMILES: CC(C)=CCNC(=N)NCCCC1NC2=CC=C(C(=O)O)C=C2C2C1CCN2C(=N)NCC=C(C)C
InChI: InChI=1S/C27H41N7O2/c1-17(2)9-13-31-26(28)30-12-5-6-22-20-11-15-34(27(29)32-14-10-18(3)4)24(20)21-16-19(25(35)36)7-8-23(21)33-22/h7-10,16,20,22,24,33H,5-6,11-15H2,1-4H3,(H2,29,32)(H,35,36)(H3,28,30,31)
InChIKey: LUENCTUIABKZJY-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Martinella | Acrididae | Orthoptera | Insecta | Arthropoda | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 495.6720000000003
TPSA？: 136.36
MolLogP？: 3.8928400000000014
Number of H-Donors: 7
Number of H-Acceptors: 4
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|