Ambactin
AlkaPlorer ID: AK026427
Synonym: None
IUPAC Name: 3-[(2S,5R,8S,11R,14S,17R)-14-(4-aminobutyl)-5,11-dibenzyl-17-(hydroxymethyl)-8-(2-methylpropyl)-3,6,9,12,15,18-hexaoxo-1,4,7,10,13,16-hexazacyclooctadec-2-yl]propanamide
Structure
SMILES: CC(C)C[C@@H]1N=C(O)[C@@H](CC2=CC=CC=C2)N=C(O)[C@H](CCC(=N)O)N=C(O)[C@@H](CO)N=C(O)[C@H](CCCCN)N=C(O)[C@@H](CC2=CC=CC=C2)N=C1O
InChI: InChI=1S/C38H54N8O8/c1-23(2)19-28-35(51)45-29(20-24-11-5-3-6-12-24)36(52)41-26(15-9-10-18-39)33(49)46-31(22-47)38(54)42-27(16-17-32(40)48)34(50)44-30(37(53)43-28)21-25-13-7-4-8-14-25/h3-8,11-14,23,26-31,47H,9-10,15-22,39H2,1-2H3,(H2,40,48)(H,41,52)(H,42,54)(H,43,53)(H,44,50)(H,45,51)(H,46,49)/t26-,27-,28-,29+,30+,31+/m0/s1
InChIKey: HMXRHVCZYGEXRQ-JYMVZIKVSA-N
Reference
Yeast Homologous Recombination Cloning Leading to the Novel Peptides Ambactin and Xenolindicin
PubChem CID: 139583382
LOTUS: LTS0174140
{NPAtlas: NPA001035
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Xenorhabdus sp. | Xenorhabdus | Morganellaceae | Enterobacterales | Gammaproteobacteria | Pseudomonadota | None | Bacteria |
Properties Information
Molecule Weight: 750.8979999999999
TPSA？: 285.87
MolLogP？: 4.918870000000006
Number of H-Donors: 10
Number of H-Acceptors: 9
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|