Tripropeptin D
AlkaPlorer ID: AK022600
Synonym: '', 'Tripropeptin D'
IUPAC Name: (2R)-2-[(1R,7S,10S,13R,16S,21S,22S,25S,28R,32R)-25-[(S)-carboxy(hydroxy)methyl]-10-[3-(diaminomethylideneamino)propyl]-21-hydroxy-32-[(1R)-1-hydroxyethyl]-16-(hydroxymethyl)-28-(11-methyldodecyl)-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)CCCCCCCCCC[C@@H]1CC(O)=N[C@H]([C@@H](C)O)C(=O)N2CCC[C@@H]2C(=O)N2CCC[C@H]2C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@H]([C@@H](O)C(=O)O)C(O)=N[C@@H](CO)C(=O)N2CC[C@H](O)[C@H]2C(O)=N[C@@H]([C@H](O)C(=O)O)C(=O)O1
InChI: InChI=1S/C52H85N11O19/c1-27(2)15-10-8-6-4-5-7-9-11-16-29-25-35(67)58-36(28(3)65)48(76)62-23-14-19-33(62)47(75)61-22-13-18-32(61)43(71)56-30(17-12-21-55-52(53)54)42(70)59-37(40(68)49(77)78)44(72)57-31(26-64)46(74)63-24-20-34(66)39(63)45(73)60-38(51(81)82-29)41(69)50(79)80/h27-34,36-41,64-66,68-69H,4-26H2,1-3H3,(H,56,71)(H,57,72)(H,58,67)(H,59,70)(H,60,73)(H,77,78)(H,79,80)(H4,53,54,55)/t28-,29-,30+,31+,32+,33-,34+,36-,37-,38+,39+,40-,41+/m1/s1
InChIKey: DETFTHHTKCLOGR-DNXHFXPASA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | None | Xanthomonadaceae | Xanthomonadales | Gammaproteobacteria | Pseudomonadota | None | Bacteria |
Properties Information
Molecule Weight: 1168.3100000000002
TPSA？: 487.83000000000015
MolLogP？: -0.0444300000000013
Number of H-Donors: 15
Number of H-Acceptors: 18
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|