Tripropeptin C
AlkaPlorer ID: AK325954
Synonym: None
IUPAC Name: 2-[25-[carboxy(hydroxy)methyl]-10-[3-(diaminomethylideneamino)propyl]-21-hydroxy-32-(1-hydroxyethyl)-16-(hydroxymethyl)-28-(10-methylundecyl)-2,8,11,14,17,23,26,30,33-nonaoxo-27-oxa-3,9,12,15,18,24,31,34-octazatetracyclo[32.3.0.03,7.018,22]heptatriacontan-13-yl]-2-hydroxyacetic acid
Structure
SMILES: CC(C)CCCCCCCCCC1CC(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)N2CCC(O)C2C(O)=NC(C(O)C(=O)O)C(=O)O1
InChI: InChI=1S/C51H83N11O19/c1-26(2)14-9-7-5-4-6-8-10-15-28-24-34(66)57-35(27(3)64)47(75)61-22-13-18-32(61)46(74)60-21-12-17-31(60)42(70)55-29(16-11-20-54-51(52)53)41(69)58-36(39(67)48(76)77)43(71)56-30(25-63)45(73)62-23-19-33(65)38(62)44(72)59-37(50(80)81-28)40(68)49(78)79/h26-33,35-40,63-65,67-68H,4-25H2,1-3H3,(H,55,70)(H,56,71)(H,57,66)(H,58,69)(H,59,72)(H,76,77)(H,78,79)(H4,52,53,54)
InChIKey: ZRHHHIZQDIARCA-UHFFFAOYSA-N
Reference
PubChem CID: 58960776
CAS: 363164-63-0
LOTUS: LTS0219591
COCONUT: CNP0141434.2
{NPAtlas: NPA010637
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Lysobacter sp. | Lysobacter | Xanthomonadaceae | Xanthomonadales | Gammaproteobacteria | Pseudomonadota | None | Bacteria |
Properties Information
Molecule Weight: 1154.283
TPSA？: 487.83000000000015
MolLogP？: -0.4345300000000021
Number of H-Donors: 15
Number of H-Acceptors: 18
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|