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Substance Name: Garryine monohydrate
RN: 6056-63-9
UNII: 8Y21153FEB
InChIKey: GDXYKOANKGZKBF-GFNIBYTNSA-N

Molecular Formula

  • C22-H33-N-O2.H2-O

Molecular Weight

  • 361.5225
 
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Names and Synonyms

Name of Substance

  • Garryine monohydrate

Synonyms

  • 6H,13H-3,5a-Methano-8,13a-propanocyclohept(H)oxazolo(3,2-b)isoquinolin-5-ol, dodecahydro-8-methyl-4-methylene-, monohydrate, (3R-(3alpha,5alpha,5aalpha,7abeta,8beta,8aalpha,13abeta,13bbeta))-
  • Garryine monohydrate
  • Garryine monohydrate [MI]
  • Garryine, monohydrate
  • UNII-8Y21153FEB

Registry Numbers

CAS Registry Number

  • 6056-63-9

FDA UNII

  • 8Y21153FEB

System Generated Number

  • 0006056639

Structure Descriptors

InChI

1S/C22H33NO2.H2O/c1-14-15-4-5-17-21(12-15,18(14)24)9-6-16-20(2)7-3-8-22(16,17)13-23-10-11-25-19(20)23;/h15-19,24H,1,3-13H2,2H3;1H2/t15-,16-,17-,18+,19-,20-,21-,22+;/m1./s1

InChIKey

GDXYKOANKGZKBF-GFNIBYTNSA-N

Smiles

O.C[C@]12CCC[C@]3(CN4CCO[C@H]14)[C@@H]2CC[C@@]56C[C@@H](CC[C@@H]35)C(=C)[C@@H]6O