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Details

Stereochemistry ABSOLUTE
Molecular Formula C9H16NO2
Molecular Weight 170.2288
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 6
E/Z Centers 0
Charge 1

SHOW SMILES / InChI
Structure of Hexahydro-6-hydroxy-4,4-dimethyl-2,5-methano-2H-furo[3,2-b]pyrrolium, (2S,3aR,5S,6S,6aS)-

SMILES

C[N+]1(C)[C@@H]2C[C@@H]3C[C@H]1[C@H](O)[C@H]2O3

InChI

InChIKey=DXIKCPKBYKKXPY-PQFOHKHZSA-N
InChI=1S/C9H16NO2/c1-10(2)6-3-5-4-7(10)9(12-5)8(6)11/h5-9,11H,3-4H2,1-2H3/q+1/t5-,6-,7+,8-,9-/m0/s1

HIDE SMILES / InChI

Molecular Formula C9H16NO2
Molecular Weight 170.2288
Charge 1
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 17:11:17 GMT 2025
Edited
by admin
on Wed Apr 02 17:11:17 GMT 2025
Record UNII
LUP2ZH6EMS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(2S,3aR,5S,6S,6aS)-Hexahydro-6-hydroxy-4,4-dimethyl-2,5-methano-2H-furo[3,2-b]pyrrolium
Preferred Name English
Hexahydro-6-hydroxy-4,4-dimethyl-2,5-methano-2H-furo[3,2-b]pyrrolium, (2S,3aR,5S,6S,6aS)-
Systematic Name English
2,5-Methano-2H-furo[3,2-b]pyrrolium, hexahydro-6-hydroxy-4,4-dimethyl-, (2S,3aR,5S,6S,6aS)-
Systematic Name English
Code System Code Type Description
PUBCHEM
131699307
Created by admin on Wed Apr 02 17:11:17 GMT 2025 , Edited by admin on Wed Apr 02 17:11:17 GMT 2025
PRIMARY
CAS
845958-14-7
Created by admin on Wed Apr 02 17:11:17 GMT 2025 , Edited by admin on Wed Apr 02 17:11:17 GMT 2025
PRIMARY
CAS
685817-10-1
Created by admin on Wed Apr 02 17:11:17 GMT 2025 , Edited by admin on Wed Apr 02 17:11:17 GMT 2025
SUPERSEDED
FDA UNII
LUP2ZH6EMS
Created by admin on Wed Apr 02 17:11:17 GMT 2025 , Edited by admin on Wed Apr 02 17:11:17 GMT 2025
PRIMARY