PAX6
AlkaPlorer ID: AK058909
Synonym: None
IUPAC Name: (Z,3R)-N-[2-[[(2S)-5-(diaminomethylideneamino)-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]pentan-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](CCCNC(=N)N)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/C52H99N15O9/c1-2-3-4-5-6-7-8-9-10-22-37(68)35-44(69)61-36-45(70)62-39(28-21-34-60-52(57)58)47(72)64-43-27-15-20-33-59-46(71)38(23-11-16-29-53)63-48(73)40(24-12-17-30-54)65-49(74)41(25-13-18-31-55)66-50(75)42(67-51(43)76)26-14-19-32-56/h7-8,37-43,68H,2-6,9-36,53-56H2,1H3,(H,59,71)(H,61,69)(H,62,70)(H,63,73)(H,64,72)(H,65,74)(H,66,75)(H,67,76)(H4,57,58,60)/b8-7-/t37-,38+,39+,40-,41-,42+,43-/m1/s1
InChIKey: AYZHFLVNHAQMID-JVYDVMDSSA-N
Reference
Structure elucidation and biosynthesis of lysine-rich cyclic peptides in Xenorhabdus nematophila
PubChem CID: 53382112
LOTUS: LTS0213917
{NPAtlas: NPA005434
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Xenorhabdus nematophila | Xenorhabdus | Morganellaceae | Enterobacterales | Gammaproteobacteria | Pseudomonadota | None | Bacteria |
Properties Information
Molecule Weight: 1078.459999999999
TPSA？: 446.93000000000006
MolLogP？: 6.261070000000013
Number of H-Donors: 16
Number of H-Acceptors: 14
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|