Chemical Compound

SCHEMBL13608871

CAS Registry Number 842149-91-1
SCHEMBL13608871 chemical structure
Primary Record

SCHEMBL13608871

In stock
9,409 g
Purity
99.3 %
CAS
842149-91-1

Compound Identifiers & Properties

CAS
842149-91-1
PubChem CID
57936730
SMILES
CC(C)(C)OC(=O)NCCCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N2C[C@@H](C[C@H]2C(=O)N[C@H](C(=O)N[C@@H](C(=O)N1)CC3=CN(C4=CC=CC=C43)C(=O)OC(C)(C)C)C5=CC=CC=C5)OC(=O)NCCNC(=O)OC(C)(C)C)CC6=CC=CC=C6)CC7=CC=C(C=C7)OCC8=CC=CC=C8
Canonical SMILES
CC(C)(C)OC(=O)NCCCC[C@@H]1NC(=O)[C@@H](Cc2cn(C(=O)OC(C)(C)C)c3ccccc23)NC(=O)[C@H](c2ccccc2)NC(=O)[C@@H]2C[C@@H](OC(=O)NCCNC(=O)OC(C)(C)C)CN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(OCc3ccccc3)cc2)NC1=O

Names & Synonyms

  • SCHEMBL13608871
  • oxadiazole-containing compound,12c
  • 842149-91-1
  • Cyclo[(2S)-2-phenylglycyl-1-[(1,1-dimethylethoxy)carbonyl]-D-tryptophyl-N6-[(1,1-dimethylethoxy)carbonyl]-L-lysyl-O-(phenylmethyl)-L-tyrosyl-L-phenylalanyl-(4R)-4-[[[[2-[[(1,1-dimethylethoxy)carbonyl]amino]ethyl]amino]carbonyl]oxy]-L-prolyl]
  • cyclo[Pro(4-OCO-NH-CH2-CH2-NH-Boc)-Phg-D-Trp(BoC)-Lys(Boc)-Tyr(Bzl)-Phe]