Chemical Compound

Acyldepsipeptide 4

CAS Registry Number 502965-06-2
Acyldepsipeptide 4 chemical structure
Primary Record

Acyldepsipeptide 4

In stock
6,921 g
Purity
98.9 %
CAS
502965-06-2

Compound Identifiers & Properties

CAS
502965-06-2
PubChem CID
11679386
SMILES
CCCC/C=C/C(=O)N[C@@H](CC1=CC(=CC(=C1)F)F)C(=O)N[C@H]2COC(=O)[C@@H]3C[C@H](CN3C(=O)[C@@H](NC(=O)[C@@H]4CCCCN4C(=O)[C@@H]5CCCN5C2=O)C)C
Canonical SMILES
CCCC/C=C/C(=O)N[C@@H](Cc1cc(F)cc(F)c1)C(=O)N[C@H]1COC(=O)[C@@H]2C[C@@H](C)CN2C(=O)[C@H](C)NC(=O)[C@@H]2CCCCN2C(=O)[C@@H]2CCCN2C1=O

Names & Synonyms

  • Acyldepsipeptide 4
  • ADEP4
  • CHEMBL3764224
  • SCHEMBL14131119
  • BAEUBYUDIYWBPI-HQKUAFLWSA-N
  • GLXC-21594
  • CID11679386
  • CID 11679386
  • J3.411.138C
  • N-[N-(2-Heptenoyl)-3,5-difluoro-L-phenylalanyl]cyclo(Ser*-Pro-L-Pip-Ala-4beta-methyl-Pro-)
  • (E)-Hept-2-enoic Acid [(S)-2-(3,5-difluorophenyl)-1-((3S,9S,13S,15R,19S,22S)-15,19-Dimethyl-2,8,12,18,21-pentaoxo-11-oxa-1,7,17,20-tetraaza-tetracyclo[20.4.0.03,7.013,17]hexacos-9-ylcarbamoyl)-ethyl]-amide
  • (E)-N-[(1S)-1-[(3,5-difluorophenyl)methyl]-2-[[dimethyl(pentaoxo)[?]yl]amino]-2-oxo-ethyl]hept-2-enamide
  • (E)-N-[(2S)-3-(3,5-difluorophenyl)-1-[[(3S,9S,13S,15R,19S,22S)-15,19-dimethyl-2,8,12,18,21-pentaoxo-11-oxa-1,7,17,20-tetrazatetracyclo[20.4.0.03,7.013,17]hexacosan-9-yl]amino]-1-oxopropan-2-yl]hept-2-enamide
  • 502965-06-2
  • N-[(1S)-2-(3,5-difluorophenyl)-1-{[(3S,9S,13S,15R,19S,22S)-15,19-dimethyl-2,8,12,18,21-pentaoxo-11-oxa-1,7,17,20-tetraazatetracyclo[20.4.0.03,7.013,17]hexacosan-9-yl]carbamoyl}ethyl]hept-2-enamide
  • N-[(2S)-3-(3,5-difluorophenyl)-1-[[(3S,9S,13S,15R,19S,22S)-15,19-dimethyl-2,8,12,18,21-pentaoxo-11-oxa-1,7,17,20-tetrazatetracyclo[20.4.0.03,7.013,17]hexacosan-9-yl]amino]-1-oxopropan-2-yl]heptanamide