Antibiotic 38G272
AlkaPlorer ID: AK288431
Synonym: N-(5-Hydroxytetradecanoyl)threonylalanylalanylalanyltyrosylvaline, 38G272
IUPAC Name: 2-[[2-[2-[2-[2-[[3-hydroxy-2-(5-hydroxytetradecanoylamino)butanoyl]amino]propanoylamino]propanoylamino]propanoylamino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylbutanoic acid
Structure
SMILES: CCCCCCCCCC(O)CCCC(=O)NC(C(=O)NC(C)C(=O)NC(C)C(=O)NC(C)C(=O)NC(CC1=CC=C(O)C=C1)C(=O)NC(C(=O)O)C(C)C)C(C)O
InChI: InChI=1S/C41H68N6O11/c1-8-9-10-11-12-13-14-16-30(49)17-15-18-33(51)46-35(28(7)48)40(56)44-26(5)37(53)42-25(4)36(52)43-27(6)38(54)45-32(23-29-19-21-31(50)22-20-29)39(55)47-34(24(2)3)41(57)58/h19-22,24-28,30,32,34-35,48-50H,8-18,23H2,1-7H3,(H,42,53)(H,43,52)(H,44,56)(H,45,54)(H,46,51)(H,47,55)(H,57,58)
InChIKey: YWMNSSYALLPGHZ-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Pochonia | Clavicipitaceae | Hypocreales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 821.0260000000002
TPSA？: 272.59
MolLogP？: 1.6965000000000103
Number of H-Donors: 10
Number of H-Acceptors: 10
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|