(Q105214372)

English

(S)-3-[(2S,3R,4R,5S)-2,3,4,6-tetrahydroxy-5-(L-leucyl)aminohexanoyl]amino-3-phenylpropionic acid

chemical compound

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instance of

type of chemical entity

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subclass of

3-[[5-[(2-Amino-4-methylpentanoyl)amino]-2,3,4,6-tetrahydroxyhexanoyl]amino]-3-phenylpropanoic acid

1 reference

based on heuristic

inferred from SMILES

mass

455.226765016 dalton

1 reference

1 reference

inferred from InChIKey

chemical formula

C₂₁H₃₃N₃O₈

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canonical SMILES

CC(C)CC(N)C(=O)NC(CO)C(O)C(O)C(O)C(=O)NC(CC(=O)O)c1ccccc1

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isomeric SMILES

CC(C)C[C@H](N)C(=O)N[C@@H](CO)[C@@H](O)[C@@H](O)[C@H](O)C(=O)N[C@@H](CC(=O)O)c1ccccc1

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found in taxon

Bacillus

1 reference

stated in

Pyloricidins, novel anti-helicobacterpylori antibiotics produced by Bacillus sp. I. Taxonomy, fermentation and biological activity.

Identifiers

InChI

InChI=1S/C21H33N3O8/c1-11(2)8-13(22)20(31)24-15(10-25)17(28)18(29)19(30)21(32)23-14(9-16(26)27)12-6-4-3-5-7-12/h3-7,11,13-15,17-19,25,28-30H,8-10,22H2,1-2H3,(H,23,32)(H,24,31)(H,26,27)/t13-,14-,15-,17+,18+,19-/m0/s1

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InChIKey

PSSAPTMCCOBBEJ-YEECJIJSSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

PSSAPTMCCOBBEJ-YEECJIJSSA-N

1 reference

(Q105214372)

(S)-3-[(2S,3R,4R,5S)-2,3,4,6-tetrahydroxy-5-(L-leucyl)aminohexanoyl]amino-3-phenylpropionic acid

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Identifiers

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