Chemical Compound

Kahalalide F

CAS Registry Number 149204-42-2
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Kahalalide F chemical structure
Primary Record

Kahalalide F

In stock
7,488 g
Purity
98.9 %
CAS
149204-42-2

Compound Identifiers & Properties

CAS
149204-42-2
PubChem CID
9898671
SMILES
CC[C@H](C)[C@@H]1C(=O)N[C@@H](C(=O)N[C@H](C(=O)N/C(=C\C)/C(=O)N[C@H](C(=O)O[C@@H]([C@H](C(=O)N1)NC(=O)[C@@H]([C@@H](C)CC)NC(=O)[C@H](CCCN)NC(=O)[C@H]2CCCN2C(=O)[C@@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@@H](C(C)C)NC(=O)CCCC(C)C)C)C(C)C)CC3=CC=CC=C3)C(C)C
Canonical SMILES
C/C=C1\NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](C(C)C)NC(=O)[C@@H]([C@@H](C)CC)NC(=O)[C@H](NC(=O)[C@H](NC(=O)[C@H](CCCN)NC(=O)[C@H]2CCCN2C(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)CCCC(C)C)C(C)C)[C@@H](C)O)C(C)C)C(C)C)[C@@H](C)CC)[C@@H](C)OC(=O)[C@H](C(C)C)NC1=O

Names & Synonyms

  • Kahalalide F
  • Kahalide F
  • BQD6E2ZXEA
  • UNII-BQD6E2ZXEA
  • RefChem:150828
  • KAHALALIDE F [MI]
  • pentamethyl-phenyl-disiloxane
  • SCHEMBL60285
  • pm-92102
  • CHEMBL513639
  • DTXSID301031233
  • CHEBI:222952
  • DTXCID401516246
  • NSC668814
  • 149204-42-2
  • C75H124N14O16
  • CID9898671
  • NSC-668814
  • C75-H124-N14-O16
  • Q27274814
  • (2R)-N-[(2S)-5-amino-1-[[(2R,3S)-1-[[(3S,6Z,9S,12R,15R,18R,19R)-9-benzyl-15-[(2S)-butan-2-yl]-6-ethylidene-19-methyl-2,5,8,11,14,17-hexaoxo-3,12-di(propan-2-yl)-1-oxa-4,7,10,13,16-pentazacyclononadec-18-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-1-oxopentan-2-yl]-1-[(2R)-2-[[(2S)-2-[[(2S,3R)-3-hydroxy-2-[[(2R)-3-methyl-2-(5-methylhexanoylamino)butanoyl]amino]butanoyl]amino]-3-methylbutanoyl]amino]-3-methylbutanoyl]pyrrolidine-2-carboxamide
  • 1-Oxa-4,10,13,16-pentaazacyclononadecane, cyclic peptide derivative
  • (2R)-N-((2S)-5-amino-1-(((2R)-1-(((3S,6Z,9S,12R,15R,18R)-9-benzyl-15-butan-2-yl-6-ethylidene-19-methyl-2,5,8,11,14,17-hexaoxo-3,12-di(propan-2-yl)-1-oxa-4,7,10,13,16-pentazacyclononadec-18-yl)amino)-3-methyl-1-oxopentan-2-yl)amino)-1-oxopentan-2-yl)-1-((2S)-2-(((2R)-2-(((2S)-3-hydroxy-2-(((2R)-3-methyl-2-(5-methylhexanoylamino)butanoyl)amino)butanoyl)amino)-3-methylbutanoyl)amino)-3-methylbutanoyl)pyrrolidine-2-carboxamide
  • (2R)-N-((2S)-5-amino-1-(((2R)-1-(((3S,6Z,9S,12R,18R)-9-benzyl-15-((2S)-butan-2-yl)-6-ethylidene-19-methyl-2,5,8,11,14,17-hexaoxo-3,12-di(propan-2-yl)-1-oxa-4,7,10,13,16-pentazacyclononadec-18-yl)amino)-3-methyl-1-oxopentan-2-yl)amino)-1-oxopentan-2-yl)-1-((2R)-2-(((2S)-2-(((2S)-3-hydroxy-2-(((2R)-3-methyl-2-(5-methylhexanoylamino)butanoyl)amino)butanoyl)amino)-3-methylbutanoyl)amino)-3-methylbutanoyl)pyrrolidine-2-carboxamide
  • (2R)-N-((2S)-5-amino-1-(((2R)-1-(((6Z,9S,15R)-9-benzyl-15-butan-2-yl-6-ethylidene-19-methyl-2,5,8,11,14,17-hexaoxo-3,12-di(propan-2-yl)-1-oxa-4,7,10,13,16-pentazacyclononadec-18-yl)amino)-3-methyl-1-oxopentan-2-yl)amino)-1-oxopentan-2-yl)-1-(2-((2-((3-hydroxy-2-((3-methyl-2-(5-methylhexanoylamino)butanoyl)amino)butanoyl)amino)-3-methylbutanoyl)amino)-3-methylbutanoyl)pyrrolidine-2-carboxamide
  • (2R)-N-((2S)-5-amino-1-(((2R,3R)-1-(((3S,6Z,9S,12R,15R,18R,19S)-9-benzyl-15-((2R)-butan-2-yl)-6-ethylidene-19-methyl-2,5,8,11,14,17-hexaoxo-3,12-di(propan-2-yl)-1-oxa-4,7,10,13,16-pentazacyclononadec-18-yl)amino)-3-methyl-1-oxopentan-2-yl)amino)-1-oxopentan-2-yl)-1-((2R)-2-(((2S)-2-(((2S,3R)-3-hydroxy-2-(((2R)-3-methyl-2-(5-methylhexanoylamino)butanoyl)amino)butanoyl)amino)-3-methylbutanoyl)amino)-3-methylbutanoyl)pyrrolidine-2-carboxamide
  • L-Valine, N-(5-methyl-1-oxohexyl)-D-valyl-L-threonyl-L-valyl-D-valyl-D-prolyl-L-ornithyl-D-alloisoleucyl-D-allothreonyl-D-alloisoleucyl-D-valyl-L-phenylalanyl-(2Z)-2-amino-2-butenoly-(13.fwdarw.8)-lactone
  • L-VALINE, N-(5-METHYL-1-OXOHEXYL)-D-VALYL-L-THREONYL-L-VALYL-D-VALYL-D-PROLYL-L-ORNITHYL-D-ALLOISOLEUCYL-D-ALLOTHREONYL-D-ALLOISOLEUCYL-D-VALYL-L-PHENYLALANYL-(2Z)-2-AMINO-2-BUTENOYL-, (13->8)-LACTONE
  • Valine, N-(5-methyl-1-oxohexyl)valylthreonylvalylvalyl-D-prolyl-L-ornithyl-D-alloisoleucylthreonyl-D-alloisoleucylvalyl-L-phenylalanyl-(Z)-2,3-didehydro-2-aminobutanoyl-, rho-lactone