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Substance Name: Enniatin A1
RN: 4530-21-6
UNII: 39458RI529
InChIKey: OWUREPXBPJFMOK-CIRFPNLUSA-N

Molecular Weight

  • 667.8789
 
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Names and Synonyms

Name of Substance

  • Enniatin A1

Synonyms

  • Cyclo((2R)-2-hydroxy-3-methylbutanoyl-N-methyl-L-isoleucyl-(2R)-2-hydroxy-3-methylbutanoyl-N-methyl-L-isoleucyl-(2R)-2-hydroxy-3-methylbutanoyl-N-methyl-L-valyl)
  • UNII-39458RI529

Registry Numbers

CAS Registry Number

  • 4530-21-6

FDA UNII

  • 39458RI529

System Generated Number

  • 0004530216

Structure Descriptors

InChI

1S/C35H61N3O9/c1-16-22(11)25-34(43)46-27(19(5)6)30(39)36(13)24(18(3)4)33(42)45-28(20(7)8)31(40)37(14)26(23(12)17-2)35(44)47-29(21(9)10)32(41)38(25)15/h18-29H,16-17H2,1-15H3/t22-,23-,24-,25-,26-,27+,28+,29+/m0/s1

InChIKey

OWUREPXBPJFMOK-CIRFPNLUSA-N

Smiles

CC[C@H](C)[C@H]1C(=O)O[C@@H](C(=O)N([C@H](C(=O)O[C@@H](C(=O)N([C@H](C(=O)O[C@@H](C(=O)N1C)C(C)C)[C@@H](C)CC)C)C(C)C)C(C)C)C)C(C)C