(2S)-2-{2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]propanamido]-3-methylbutanamido]-4-methylpentanamido]-3-methylbutanamido]-4-methylpentanamido]acetamido}propanoic acid
AlkaPlorer ID: AK355000
Synonym: None
IUPAC Name: 2-[[2-[[2-[[2-[[2-[[2-[2-[(2-amino-3-methylbutanoyl)amino]propanoylamino]-3-methylbutanoyl]amino]-4-methylpentanoyl]amino]-3-methylbutanoyl]amino]-4-methylpentanoyl]amino]acetyl]amino]propanoic acid
Structure
SMILES: CC(C)CC(N=C(O)C(N=C(O)C(C)N=C(O)C(N)C(C)C)C(C)C)C(O)=NC(C(O)=NC(CC(C)C)C(O)=NCC(O)=NC(C)C(=O)O)C(C)C
InChI: InChI=1S/C35H64N8O9/c1-16(2)13-23(30(46)37-15-25(44)38-22(12)35(51)52)40-34(50)28(20(9)10)43-31(47)24(14-17(3)4)41-33(49)27(19(7)8)42-29(45)21(11)39-32(48)26(36)18(5)6/h16-24,26-28H,13-15,36H2,1-12H3,(H,37,46)(H,38,44)(H,39,48)(H,40,50)(H,41,49)(H,42,45)(H,43,47)(H,51,52)
InChIKey: CJVFIJXEPCVCTK-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Enterococcus faecalis | Enterococcus | Enterococcaceae | Lactobacillales | Bacilli | Bacillota | None | Bacteria |
Properties Information
Molecule Weight: 740.9440000000001
TPSA？: 291.44999999999993
MolLogP？: 5.405400000000009
Number of H-Donors: 9
Number of H-Acceptors: 9
RingCount: 0
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|