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Details

Stereochemistry RACEMIC
Molecular Formula C15H22O
Molecular Weight 218.3346
Optical Activity ( + / - )
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

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

SMILES

C[C@@H]1CC(=O)C=C2CC[C@H](C[C@@]12C)C(C)=C

InChI

InChIKey=WTOYNNBCKUYIKC-JMSVASOKSA-N
InChI=1S/C15H22O/c1-10(2)12-5-6-13-8-14(16)7-11(3)15(13,4)9-12/h8,11-12H,1,5-7,9H2,2-4H3/t11-,12-,15+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
NOOTKATONE, (±)-
Common Name English
2(3H)-NAPHTHALENONE, 4,4A,5,6,7,8-HEXAHYDRO-4,4A-DIMETHYL-6-(1-METHYLETHENYL)-, (4R,4AS,6R)-REL
Systematic Name English
(4RS,4ASR,6RS)-4,4A,5,6,7,8-HEXAHYDRO-4,4A-DIMETHYL-6-(1-METHYLETHENYL)-2(3H)-NAPHTHALENONE
Systematic Name English
7.BETA.H-EREMOPHILA-1(10),11-DIEN-2-ONE -
Common Name English
NOOTKATONE (±)-FORM [MI]
Common Name English
(±)-NOOTKATONE
Common Name English
Code System Code Type Description
MERCK INDEX
m8040
Created by admin on Sat Dec 16 08:57:45 UTC 2023 , Edited by admin on Sat Dec 16 08:57:45 UTC 2023
PRIMARY Merck Index
PUBCHEM
1268142
Created by admin on Sat Dec 16 08:57:45 UTC 2023 , Edited by admin on Sat Dec 16 08:57:45 UTC 2023
PRIMARY
FDA UNII
3K3OKV2A5A
Created by admin on Sat Dec 16 08:57:45 UTC 2023 , Edited by admin on Sat Dec 16 08:57:45 UTC 2023
PRIMARY
CAS
28834-25-5
Created by admin on Sat Dec 16 08:57:45 UTC 2023 , Edited by admin on Sat Dec 16 08:57:45 UTC 2023
PRIMARY