Chemical Compound

VAKHFAFLRUNHLQ-PEBJKXEYSA-N

CAS Registry Number 121932-06-7
VAKHFAFLRUNHLQ-PEBJKXEYSA-N chemical structure
Primary Record

VAKHFAFLRUNHLQ-PEBJKXEYSA-N

In stock
8,766 g
Purity
98.9 %
CAS
121932-06-7

Compound Identifiers & Properties

CAS
121932-06-7
PubChem CID
102216321
SMILES
CC[C@H](C)[C@@H](C(=N)O)N=C([C@H](C)N=C([C@H](CC(=N)O)N=C([C@H](CCCNC(=N)N)N=C([C@H](CCCNC(=N)N)N=C(CN=C([C@H]([C@@H](C)O)N=C([C@H](CCCNC(=N)N)N=C(CN=C([C@H](CO)N=C([C@H](C)N=C([C@H]([C@@H](C)CC)N=C([C@H](CC1=CC=CC=C1)N=C([C@H](CC(=O)O)N=C([C@H](C)N=C([C@H](CC2=CC=C(C=C2)O)N=C([C@H]([C@@H](C)O)N)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O
Canonical SMILES
CC[C@H](C)[C@H](N=C(O)[C@H](C)N=C(O)[C@H](CC(=N)O)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CCCNC(=N)N)N=C(O)CN=C(O)[C@@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)CN=C(O)[C@H](CO)N=C(O)[C@H](C)N=C(O)[C@@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](C)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@@H](N)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)C(=N)O

Names & Synonyms

  • VAKHFAFLRUNHLQ-PEBJKXEYSA-N
  • AS-85409
  • PKA inhibitor fragment (6-22) amide TFA salt
  • 121932-06-7