Rufulamide
AlkaPlorer ID: AK312764
Synonym: None
IUPAC Name: 2-[[4-carboxy-4-[[3-(2-carboxyanilino)-3-oxopropanoyl]amino]butanoyl]amino]benzoic acid
Structure
SMILES: O=C(O)C1=CC=CC=C1N=C(O)CCC(N=C(O)CC(O)=NC1=CC=CC=C1C(=O)O)C(=O)O
InChI: InChI=1S/C22H21N3O9/c26-17(23-14-7-3-1-5-12(14)20(29)30)10-9-16(22(33)34)25-19(28)11-18(27)24-15-8-4-2-6-13(15)21(31)32/h1-8,16H,9-11H2,(H,23,26)(H,24,27)(H,25,28)(H,29,30)(H,31,32)(H,33,34)
InChIKey: ODDUXTYPXPCFIC-UHFFFAOYSA-N
Reference
Isolation and synthesis of rufulamide, an oligopeptide analogue from Metzgeria rufula
PubChem CID: 101713142
LOTUS: LTS0066249
COCONUT: CNP0223621.1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Metzgeria rufula | Metzgeria | Metzgeriaceae | Metzgeriales | Jungermanniopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 471.4220000000002
TPSA？: 209.67
MolLogP？: 3.539200000000001
Number of H-Donors: 6
Number of H-Acceptors: 6
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|