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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H22O6
Molecular Weight 346.3744
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-FORMYLZEARALENONE

SMILES

C[C@H]1CCCC(=O)CCC\C=C\C2=C(C(O)=CC(O)=C2C=O)C(=O)O1

InChI

InChIKey=XERJFBYLBCKWCY-KFRNIWOLSA-N
InChI=1S/C19H22O6/c1-12-6-5-8-13(21)7-3-2-4-9-14-15(11-20)16(22)10-17(23)18(14)19(24)25-12/h4,9-12,22-23H,2-3,5-8H2,1H3/b9-4+/t12-/m0/s1

HIDE SMILES / InChI

Molecular Formula C19H22O6
Molecular Weight 346.3744
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 Wed Apr 02 11:33:21 GMT 2025
Edited
by admin
on Wed Apr 02 11:33:21 GMT 2025
Record UNII
63UI2ZL7AO
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-FORMYLZEARALENONE
Common Name English
1H-2-BENZOXACYCLOTETRADECIN-13-CARBOXALDEHYDE, 3,4,5,6,7,8,9,10-OCTAHYDRO-14,16-DIHYDROXY-3-METHYL-1,7-DIOXO-, (3S,11E)-
Preferred Name English
Code System Code Type Description
PUBCHEM
76957758
Created by admin on Wed Apr 02 11:33:21 GMT 2025 , Edited by admin on Wed Apr 02 11:33:21 GMT 2025
PRIMARY
FDA UNII
63UI2ZL7AO
Created by admin on Wed Apr 02 11:33:21 GMT 2025 , Edited by admin on Wed Apr 02 11:33:21 GMT 2025
PRIMARY
CAS
41432-76-2
Created by admin on Wed Apr 02 11:33:21 GMT 2025 , Edited by admin on Wed Apr 02 11:33:21 GMT 2025
PRIMARY