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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H20O5
Molecular Weight 316.3484
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7'-DEHYDROZEARALENONE

SMILES

C[C@H]1C\C=C\C(=O)CCC\C=C\C2=C(C(O)=CC(O)=C2)C(=O)O1

InChI

InChIKey=HRUOWSYFAVIOSJ-XGXKLDBLSA-N
InChI=1S/C18H20O5/c1-12-6-5-9-14(19)8-4-2-3-7-13-10-15(20)11-16(21)17(13)18(22)23-12/h3,5,7,9-12,20-21H,2,4,6,8H2,1H3/b7-3+,9-5+/t12-/m0/s1

HIDE SMILES / InChI

Molecular Formula C18H20O5
Molecular Weight 316.3484
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 05:54:44 GMT 2023
Edited
by admin
on Sat Dec 16 05:54:44 GMT 2023
Record UNII
0T3IDE9S5B
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
7'-DEHYDROZEARALENONE
Common Name English
1H-2-BENZOXACYCLOTETRADECIN-1,7(8H)-DIONE, 3,4,9,10-TETRAHYDRO-14,16-DIHYDROXY-3-METHYL-, (3S,5E,11E)-
Systematic Name English
Code System Code Type Description
CAS
40785-63-5
Created by admin on Sat Dec 16 05:54:44 GMT 2023 , Edited by admin on Sat Dec 16 05:54:44 GMT 2023
PRIMARY
PUBCHEM
73506726
Created by admin on Sat Dec 16 05:54:44 GMT 2023 , Edited by admin on Sat Dec 16 05:54:44 GMT 2023
PRIMARY
FDA UNII
0T3IDE9S5B
Created by admin on Sat Dec 16 05:54:44 GMT 2023 , Edited by admin on Sat Dec 16 05:54:44 GMT 2023
PRIMARY