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name Structure Reference Source Properties Activities Metabolism

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-methylpentanamido]-3-phenylpropanamido]-3-hydroxybutanamido]-4-methylpentanamido]-3-methylbutanamido]propanoic acid

AlkaPlorer ID: AK253081

Synonym: None

IUPAC Name: (2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-amino-3-hydroxypropanoyl]amino]-3-methylpentanoyl]amino]-3-phenylpropanoyl]amino]-3-hydroxybutanoyl]amino]-4-methylpentanoyl]amino]-3-methylbutanoyl]amino]propanoic acid

Structure

SMILES: CC[C@H](C)[C@H](N=C(O)[C@@H](N)CO)C(O)=N[C@@H](CC1=CC=CC=C1)C(O)=N[C@H](C(O)=N[C@@H](CC(C)C)C(O)=N[C@H](C(O)=N[C@@H](C)C(=O)O)C(C)C)[C@@H](C)O

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InChI: InChI=1S/C36H59N7O10/c1-9-20(6)28(42-30(46)24(37)17-44)34(50)40-26(16-23-13-11-10-12-14-23)32(48)43-29(22(8)45)35(51)39-25(15-18(2)3)31(47)41-27(19(4)5)33(49)38-21(7)36(52)53/h10-14,18-22,24-29,44-45H,9,15-17,37H2,1-8H3,(H,38,49)(H,39,51)(H,40,50)(H,41,47)(H,42,46)(H,43,48)(H,52,53)/t20-,21-,22+,24-,25-,26-,27-,28-,29-/m0/s1

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InChIKey: UUVCOJXKWUFAMD-DYIAYGBTSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Enterococcus faecalis Enterococcus Enterococcaceae Lactobacillales Bacilli Bacillota None Bacteria

Properties Information

Molecule Weight: 749.9070000000002

TPSA？: 299.31999999999994

MolLogP？: 3.732800000000007

Number of H-Donors: 10

Number of H-Acceptors: 10

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information