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(Q105174651)
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English
xenortide C
chemical compound
(2S)-2-[(2S)-N,3-dimethyl-2-(methylamino)butanamido]-3-phenyl-N-(2-phenylethyl)propanimidic acid
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Statements
instance of
type of chemical entity
0 references
subclass of
phenethylamine alkaloid
0 references
xenortide
0 references
chemical structure
Xenortide C.svg
765 × 405; 18 KB
0 references
mass
395.257277296
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₄H₃₃N₃O₂
0 references
canonical SMILES
CNC(C(=O)N(C)C(Cc1ccccc1)C(=O)NCCc1ccccc1)C(C)C
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isomeric SMILES
CN[C@H](C(=O)N(C)[C@@H](Cc1ccccc1)C(=O)NCCc1ccccc1)C(C)C
0 references
found in taxon
Xenorhabdus nematophila
2 references
stated in
NRPS substrate promiscuity diversifies the xenematides
stated in
Xenortide Biosynthesis by Entomopathogenic Xenorhabdus nematophila
Identifiers
InChI
InChI=1S/C24H33N3O2/c1-18(2)22(25-3)24(29)27(4)21(17-20-13-9-6-10-14-20)23(28)26-16-15-19-11-7-5-8-12-19/h5-14,18,21-22,25H,15-17H2,1-4H3,(H,26,28)/t21-,22-/m0/s1
0 references
InChIKey
MXXFZXJSHIUFOL-VXKWHMMOSA-N
0 references
PubChem CID
102585016
1 reference
matched by identifier from
InChIKey
InChIKey
MXXFZXJSHIUFOL-VXKWHMMOSA-N
ChEBI ID
221177
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C24H33N3O2/c1-18(2)22(25-3)24(29)27(4)21(17-20-13-9-6-10-14-20)23(28)26-16-15-19-11-7-5-8-12-19/h5-14,18,21-22,25H,15-17H2,1-4H3,(H,26,28)/t21-,22-/m0/s1
UniChem compound ID
101297319
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA024657
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
MXXFZXJSHIUFOL-VXKWHMMOSA-N
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