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Details

Stereochemistry ACHIRAL
Molecular Formula C21H30O4
Molecular Weight 346.4605
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-DEOXYHUMULONE

SMILES

CC(C)CC(=O)C1=C(O)C(CC=C(C)C)=C(O)C(CC=C(C)C)=C1O

InChI

InChIKey=NQYBQBZOHCACCR-UHFFFAOYSA-N
InChI=1S/C21H30O4/c1-12(2)7-9-15-19(23)16(10-8-13(3)4)21(25)18(20(15)24)17(22)11-14(5)6/h7-8,14,23-25H,9-11H2,1-6H3

HIDE SMILES / InChI

Molecular Formula C21H30O4
Molecular Weight 346.4605
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 19:23:33 GMT 2025
Edited
by admin
on Mon Mar 31 19:23:33 GMT 2025
Record UNII
2G8GOM6DZY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-DEOXYHUMULONE
Common Name English
DEOXYHUMULONE, 4-
Preferred Name English
1-BUTANONE, 3-METHYL-1-(2,4,6-TRIHYDROXY-3,5-BIS(3-METHYL-2-BUTEN-1-YL)PHENYL)-
Systematic Name English
3-METHYL-1-(2,4,6-TRIHYDROXY-3,5-BIS(3-METHYL-2-BUTEN-1-YL)PHENYL)-1-BUTANONE
Systematic Name English
Code System Code Type Description
PUBCHEM
6450808
Created by admin on Mon Mar 31 19:23:33 GMT 2025 , Edited by admin on Mon Mar 31 19:23:33 GMT 2025
PRIMARY
CHEBI
134345
Created by admin on Mon Mar 31 19:23:33 GMT 2025 , Edited by admin on Mon Mar 31 19:23:33 GMT 2025
PRIMARY
EPA CompTox
DTXSID20195922
Created by admin on Mon Mar 31 19:23:33 GMT 2025 , Edited by admin on Mon Mar 31 19:23:33 GMT 2025
PRIMARY
FDA UNII
2G8GOM6DZY
Created by admin on Mon Mar 31 19:23:33 GMT 2025 , Edited by admin on Mon Mar 31 19:23:33 GMT 2025
PRIMARY
CAS
4374-93-0
Created by admin on Mon Mar 31 19:23:33 GMT 2025 , Edited by admin on Mon Mar 31 19:23:33 GMT 2025
PRIMARY