Chemical Compound

VKKPIQVVGDZIIH-PHEWCVJMSA-N

VKKPIQVVGDZIIH-PHEWCVJMSA-N chemical structure
Primary Record

VKKPIQVVGDZIIH-PHEWCVJMSA-N

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
86722418
SMILES
CC[C@@]12C[C@H]([C@@](C[C@H]1CCCC3=C2C=C4C=NN(C4=C3)C5=CC=C(C=C5)F)(C(F)(F)F)O)O.CC[C@]12C[C@@H]([C@](C[C@@H]1CCCC3=C2C=C4C=NN(C4=C3)C5=CC=C(C=C5)F)(C(F)(F)F)O)O
Canonical SMILES
CC[C@@]12C[C@@H](O)[C@](O)(C(F)(F)F)C[C@H]1CCCc1cc3c(cnn3-c3ccc(F)cc3)cc12.CC[C@]12C[C@H](O)[C@@](O)(C(F)(F)F)C[C@@H]1CCCc1cc3c(cnn3-c3ccc(F)cc3)cc12

Names & Synonyms

  • VKKPIQVVGDZIIH-PHEWCVJMSA-N
  • (2R,3S,4aR,12bR)-12b-ethyl-9-(4-fluorophenyl)-3-(trifluoromethyl)-1,2,3,4,4a,5,6,7,9,12b-decahydrobenzo[6,7]cyclohepta[1,2-f]indazole-2,3-diol; compound with (2S,3R,4aS,12bS)-12b-ethyl-9-(4-fluorophenyl)-3-(trifluoromethyl)-1,2,3,4,4a,5,6,7,9,12b-decahydrobenzo[6,7]cyclohepta[1,2-f]indazole-2,3-diol