Tripropeptins; Tripropeptin aiC
AlkaPlorer ID: AK316725
Synonym: None
IUPAC Name: None
Structure
SMILES: CCC(C)CCCCCCCCC1CC(=O)NC(C(C)O)C(=O)N2CCCC2C(=O)N2CCCC2C(=O)NC(CCCNC(=N)N)C(=O)NC(C(O)C(=O)O)C(=O)NC(CO)C(=O)N2CC(O)C(C2)C(=O)NC(C(O)C(=O)O)C(=O)O1
InChI: InChI=1S/C51H83N11O19/c1-4-26(2)14-9-7-5-6-8-10-15-28-22-35(66)57-36(27(3)64)47(75)62-21-13-18-33(62)46(74)61-20-12-17-32(61)43(71)55-30(16-11-19-54-51(52)53)42(70)58-37(39(67)48(76)77)44(72)56-31(25-63)45(73)60-23-29(34(65)24-60)41(69)59-38(50(80)81-28)40(68)49(78)79/h26-34,36-40,63-65,67-68H,4-25H2,1-3H3,(H,55,71)(H,56,72)(H,57,66)(H,58,70)(H,59,69)(H,76,77)(H,78,79)(H4,52,53,54)
InChIKey: PTHCGUFVDGVVQI-UHFFFAOYSA-N
Reference
CAS: 1089148-17-3
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Lysobacter sp. BMK333-48F3 | Lysobacter | Xanthomonadaceae | Xanthomonadales | Gammaproteobacteria | Pseudomonadota | None | Bacteria |
Properties Information
Molecule Weight: 1154.283
TPSA？: 470.38
MolLogP？: -4.778530000000027
Number of H-Donors: 15
Number of H-Acceptors: 18
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|