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Details

Stereochemistry EPIMERIC
Molecular Formula C23H34O2
Molecular Weight 342.5149
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CARDENOLIDE

SMILES

[H][C@@]1(CC[C@]2([H])[C@]3([H])CCC4CCCC[C@]4(C)[C@@]3([H])CC[C@]12C)C5=CC(=O)OC5

InChI

InChIKey=JIUWTCXNUNHEGP-GJHPUSIBSA-N
InChI=1S/C23H34O2/c1-22-11-4-3-5-16(22)6-7-17-19-9-8-18(15-13-21(24)25-14-15)23(19,2)12-10-20(17)22/h13,16-20H,3-12,14H2,1-2H3/t16?,17-,18+,19+,20-,22-,23+/m0/s1

HIDE SMILES / InChI

Molecular Formula C23H34O2
Molecular Weight 342.5149
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 6 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 17:57:25 GMT 2023
Edited
by admin
on Sat Dec 16 17:57:25 GMT 2023
Record UNII
L54QGD9LPW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CARDENOLIDE
Common Name English
5.BETA.-CARD-20(22)-ENOLIDE
Systematic Name English
CARD-20(22)-ENOLIDE
Common Name English
CARD-20(22)-ENOLIDE, (5.BETA.)-
Systematic Name English
Code System Code Type Description
WIKIPEDIA
Cardenolide
Created by admin on Sat Dec 16 17:57:25 GMT 2023 , Edited by admin on Sat Dec 16 17:57:25 GMT 2023
PRIMARY
FDA UNII
L54QGD9LPW
Created by admin on Sat Dec 16 17:57:25 GMT 2023 , Edited by admin on Sat Dec 16 17:57:25 GMT 2023
PRIMARY
CHEBI
71620
Created by admin on Sat Dec 16 17:57:25 GMT 2023 , Edited by admin on Sat Dec 16 17:57:25 GMT 2023
PRIMARY
EPA CompTox
DTXSID40952054
Created by admin on Sat Dec 16 17:57:25 GMT 2023 , Edited by admin on Sat Dec 16 17:57:25 GMT 2023
PRIMARY
PUBCHEM
53957771
Created by admin on Sat Dec 16 17:57:25 GMT 2023 , Edited by admin on Sat Dec 16 17:57:25 GMT 2023
PRIMARY
CAS
52085-71-9
Created by admin on Sat Dec 16 17:57:25 GMT 2023 , Edited by admin on Sat Dec 16 17:57:25 GMT 2023
PRIMARY