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Details

Stereochemistry ABSOLUTE
Molecular Formula C10H18O
Molecular Weight 154.2493
Optical Activity ( + )
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NEOISOPULEGOL, (+)-

SMILES

C[C@@H]1CC[C@H]([C@@H](O)C1)C(C)=C

InChI

InChIKey=ZYTMANIQRDEHIO-UTLUCORTSA-N
InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)6-10(9)11/h8-11H,1,4-6H2,2-3H3/t8-,9+,10+/m1/s1

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
NEOISOPULEGOL, (+)-
Common Name English
P-MENTH-8-EN-3-OL, (1R,3S,4S)-(+)-
Systematic Name English
(1S,2S,5R)-5-METHYL-2-(1-METHYLETHENYL)CYCLOHEXANOL
Systematic Name English
(+)-NEOISOPULEGOL
Common Name English
CYCLOHEXANOL, 5-METHYL-2-(1-METHYLETHENYL)-, (1S-(1.ALPHA.,2.ALPHA.,5.BETA.))-
Systematic Name English
Code System Code Type Description
PUBCHEM
6553885
Created by admin on Fri Dec 15 17:18:41 GMT 2023 , Edited by admin on Fri Dec 15 17:18:41 GMT 2023
PRIMARY
FDA UNII
B1A5V2613Y
Created by admin on Fri Dec 15 17:18:41 GMT 2023 , Edited by admin on Fri Dec 15 17:18:41 GMT 2023
PRIMARY
CAS
20549-46-6
Created by admin on Fri Dec 15 17:18:41 GMT 2023 , Edited by admin on Fri Dec 15 17:18:41 GMT 2023
PRIMARY
SUBSTANCE RECORD
Structure of NEOISOPULEGOL, (+)-
NIH
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