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Details

Stereochemistry ABSOLUTE
Molecular Formula C10H18O2
Molecular Weight 170.2487
Optical Activity ( + )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SOBREROL, CIS-(+)-

SMILES

CC1=CC[C@@H](C[C@@H]1O)C(C)(C)O

InChI

InChIKey=OMDMTHRBGUBUCO-IUCAKERBSA-N
InChI=1S/C10H18O2/c1-7-4-5-8(6-9(7)11)10(2,3)12/h4,8-9,11-12H,5-6H2,1-3H3/t8-,9-/m0/s1

HIDE SMILES / InChI

Molecular Formula C10H18O2
Molecular Weight 170.2487
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:38:52 GMT 2023
Edited
by admin
on Sat Dec 16 18:38:52 GMT 2023
Record UNII
E3R5TBJ77E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SOBREROL, CIS-(+)-
Common Name English
3-CYCLOHEXENE-1-METHANOL, 5-HYDROXY-.ALPHA.,.ALPHA.,4-TRIMETHYL-, (1S,5S)-
Systematic Name English
(1S,5S)-5-HYDROXY-.ALPHA.,.ALPHA.,4-TRIMETHYL-3-CYCLOHEXENE-1-METHANOL
Common Name English
3-CYCLOHEXENE-1-METHANOL, 5-HYDROXY-.ALPHA.,.ALPHA.,4-TRIMETHYL-, (1S-CIS)-
Common Name English
(+)-CIS-SOBREROL
Common Name English
Code System Code Type Description
FDA UNII
E3R5TBJ77E
Created by admin on Sat Dec 16 18:38:52 GMT 2023 , Edited by admin on Sat Dec 16 18:38:52 GMT 2023
PRIMARY
PUBCHEM
854500
Created by admin on Sat Dec 16 18:38:52 GMT 2023 , Edited by admin on Sat Dec 16 18:38:52 GMT 2023
PRIMARY
CAS
454-77-3
Created by admin on Sat Dec 16 18:38:52 GMT 2023 , Edited by admin on Sat Dec 16 18:38:52 GMT 2023
PRIMARY
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