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

Details

Stereochemistry RACEMIC
Molecular Formula C18H24O2
Molecular Weight 272.382
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NIMBIOL, (±)-

SMILES

[H][C@@]12CC(=O)C3=CC(C)=C(O)C=C3[C@@]1(C)CCCC2(C)C

InChI

InChIKey=XVAVQANUJQBBFF-FUHWJXTLSA-N
InChI=1S/C18H24O2/c1-11-8-12-13(9-14(11)19)18(4)7-5-6-17(2,3)16(18)10-15(12)20/h8-9,16,19H,5-7,10H2,1-4H3/t16-,18+/m0/s1

HIDE SMILES / InChI

Molecular Formula C18H24O2
Molecular Weight 272.382
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 08:45:22 GMT 2023
Edited
by admin
on Sat Dec 16 08:45:22 GMT 2023
Record UNII
R98DK0A54O
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NIMBIOL, (±)-
Common Name English
(±)-NIMBIOL
Common Name English
(4ARS,10ARS)-2,3,4,4A,10,10A-HEXAHYDRO-6-HYDROXY-1,1,4A,7-TETRAMETHYL-9(1H)-PHENANTHRENONE
Systematic Name English
NIMBIOL (±)-FORM [MI]
Common Name English
9(1H)-PHENANTHRENONE, 2,3,4,4A,10,10A-HEXAHYDRO-6-HYDROXY-1,1,4A,7-TETRAMETHYL-, (4AR,10AR)-REL-
Systematic Name English
Code System Code Type Description
CAS
56760-98-6
Created by admin on Sat Dec 16 08:45:22 GMT 2023 , Edited by admin on Sat Dec 16 08:45:22 GMT 2023
PRIMARY
MERCK INDEX
m7902
Created by admin on Sat Dec 16 08:45:22 GMT 2023 , Edited by admin on Sat Dec 16 08:45:22 GMT 2023
PRIMARY Merck Index
FDA UNII
R98DK0A54O
Created by admin on Sat Dec 16 08:45:22 GMT 2023 , Edited by admin on Sat Dec 16 08:45:22 GMT 2023
PRIMARY
PUBCHEM
11119228
Created by admin on Sat Dec 16 08:45:22 GMT 2023 , Edited by admin on Sat Dec 16 08:45:22 GMT 2023
PRIMARY