PAX5
AlkaPlorer ID: AK058933
Synonym: None
IUPAC Name: (Z,3R)-N-[2-[[(2S)-6-amino-1-oxo-1-[[(3S,6R,9R,12S,15R)-3,6,9,12-tetrakis(4-aminobutyl)-2,5,8,11,14-pentaoxo-1,4,7,10,13-pentazacyclononadec-15-yl]amino]hexan-2-yl]amino]-2-oxoethyl]-3-hydroxytetradec-7-enamide
Structure
SMILES: CCCCCC/C=C\CCC[C@@H](O)CC(O)=NCC(O)=N[C@@H](CCCCN)C(O)=N[C@@H]1CCCCN=C(O)[C@H](CCCCN)N=C(O)[C@@H](CCCCN)N=C(O)[C@@H](CCCCN)N=C(O)[C@H](CCCCN)N=C1O
InChI: InChI=1S/C52H99N13O9/c1-2-3-4-5-6-7-8-9-10-23-38(66)36-45(67)59-37-46(68)60-40(25-12-18-31-54)48(70)62-44-29-16-22-35-58-47(69)39(24-11-17-30-53)61-49(71)41(26-13-19-32-55)63-50(72)42(27-14-20-33-56)64-51(73)43(65-52(44)74)28-15-21-34-57/h7-8,38-44,66H,2-6,9-37,53-57H2,1H3,(H,58,69)(H,59,67)(H,60,68)(H,61,71)(H,62,70)(H,63,72)(H,64,73)(H,65,74)/b8-7-/t38-,39+,40+,41-,42-,43+,44-/m1/s1
InChIKey: DZFFFNBFSIGFMU-FFAWSATFSA-N
Reference
Structure elucidation and biosynthesis of lysine-rich cyclic peptides in Xenorhabdus nematophila
PubChem CID: 53382041
LOTUS: LTS0172574
{NPAtlas: NPA005549
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Xenorhabdus nematophila | Xenorhabdus | Morganellaceae | Enterobacterales | Gammaproteobacteria | Pseudomonadota | None | Bacteria |
Properties Information
Molecule Weight: 1050.445999999999
TPSA？: 411.05000000000007
MolLogP？: 7.126800000000014
Number of H-Donors: 14
Number of H-Acceptors: 14
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|