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Substance Name: Geodiamolide A
RN: 108675-63-4
InChIKey: AAHYELOHRHVDCH-REKDNMJYSA-N

Note

  • A cyclodepsipeptide.

Molecular Formula

  • C28-H40-I-N3-O6

Molecular Weight

  • 641.539
 
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Names and Synonyms

Name of Substance

  • Geodiamolide A

Systematic Names

  • Cyclo(L-alanyl-(2S,4E,6R,8S)-8-hydroxy-2,4,6-trimethyl-4-nonenoyl-L-alanyl-3-iodo-N-methyl-D-tyrosyl)
  • L-Alanine, N-(N-(N-(8-hydroxy-2,4,6-trimethyl-1-oxo-4-nonenyl)-L-alanyl)-3-iodo-N-methyl-D-tyrosyl)-, pi-lactone, (2S-(2R*,4E,6S*,8R*))-

Registry Numbers

CAS Registry Number

  • 108675-63-4

System Generated Number

  • 0108675634

Structure Descriptors

InChI

1S/C28H40IN3O6/c1-15(10-16(2)12-18(4)34)11-17(3)26(37)28(14-33,32(7)27(38)20(6)31)24(25(36)19(5)30)21-8-9-23(35)22(29)13-21/h8-11,13-14,16,18-20,24,34-35H,12,30-31H2,1-7H3/b15-10+,17-11+/t16-,18-,19-,20-,24?,28-/m0/s1

InChIKey

AAHYELOHRHVDCH-REKDNMJYSA-N

Smiles

C([C@](N(C)C([C@@H](N)C)=O)([C@@H](c1cc(c(O)cc1)I)C([C@@H](N)C)=O)C(\C(=C\C(=C\[C@@H](C[C@H](C)O)C)C)C)=O)=O