U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C15H26O
Molecular Weight 222.3669
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .ALPHA.-BISABOLOL, (-)-EPI-

SMILES

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

InChI

InChIKey=RGZSQWQPBWRIAQ-HUUCEWRRSA-N
InChI=1S/C15H26O/c1-12(2)6-5-11-15(4,16)14-9-7-13(3)8-10-14/h6-7,14,16H,5,8-11H2,1-4H3/t14-,15-/m1/s1

HIDE SMILES / InChI

Molecular Formula C15H26O
Molecular Weight 222.3669
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
Target ID: CHEMBL612656
Substance Class Chemical
Created
by admin
on Sat Jun 26 04:14:05 UTC 2021
Edited
by admin
on Sat Jun 26 04:14:05 UTC 2021
Record UNII
37VB7WIC8L
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
.ALPHA.-BISABOLOL, (-)-EPI-
Common Name English
EPI-.ALPHA.-BISABOLOL
Common Name English
(-)-8-EPI-.ALPHA.-BISABOLOL
Common Name English
(-)-(1'S,2R)-.ALPHA.-BISABOLOL
Common Name English
3-CYCLOHEXENE-1-METHANOL, .ALPHA.,4-DIMETHYL-.ALPHA.-(4-METHYL-3-PENTEN-1-YL)-, (.ALPHA.R,1S)-
Systematic Name English
(-)-(4S,8R)-EPI-.ALPHA.-BISABOLOL
Common Name English
ANYMOL
Common Name English
(-)-EPI-.ALPHA.-BISABOLOL
MI  
Common Name English
(-)-EPI-.ALPHA.-BISABOLOL [MI]
Common Name English
EPI-.ALPHA.-BISABOLOL, (-)-(4S,8R)-
Common Name English
(-)-ANYMOL
Common Name English
Code System Code Type Description
PUBCHEM
1616126
Created by admin on Sat Jun 26 04:14:05 UTC 2021 , Edited by admin on Sat Jun 26 04:14:05 UTC 2021
PRIMARY
FDA UNII
37VB7WIC8L
Created by admin on Sat Jun 26 04:14:05 UTC 2021 , Edited by admin on Sat Jun 26 04:14:05 UTC 2021
PRIMARY
CAS
78148-59-1
Created by admin on Sat Jun 26 04:14:05 UTC 2021 , Edited by admin on Sat Jun 26 04:14:05 UTC 2021
PRIMARY
MERCK INDEX
M2515
Created by admin on Sat Jun 26 04:14:05 UTC 2021 , Edited by admin on Sat Jun 26 04:14:05 UTC 2021
PRIMARY Merck Index
RXCUI
2118535
Created by admin on Sat Jun 26 04:14:05 UTC 2021 , Edited by admin on Sat Jun 26 04:14:05 UTC 2021
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT
Sesquiterpene Class