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Details

Stereochemistry ACHIRAL
Molecular Formula C20H22O6
Molecular Weight 358.3851
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of Pedicellin

SMILES

COC1=C(OC)C(OC)=C(C(=O)\C=C\C2=CC=CC=C2)C(OC)=C1OC

InChI

InChIKey=BHTMJPHRPUKDBL-VAWYXSNFSA-N
InChI=1S/C20H22O6/c1-22-16-15(14(21)12-11-13-9-7-6-8-10-13)17(23-2)19(25-4)20(26-5)18(16)24-3/h6-12H,1-5H3/b12-11+

HIDE SMILES / InChI

Molecular Formula C20H22O6
Molecular Weight 358.3851
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 19:43:10 GMT 2025
Edited
by admin
on Tue Apr 01 19:43:10 GMT 2025
Record UNII
7Y8622K9HX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-255994
Preferred Name English
Pedicellin
Common Name English
2-Propen-1-one, 1-(pentamethoxyphenyl)-3-phenyl-
Systematic Name English
2-PROPEN-1-ONE, 1-(PENTAMETHOXYPHENYL)-3-PHENYL-, (E)-
Systematic Name English
Pedicellin (chalcone)
Common Name English
Chalcone, 2?,3?,4?,5?,6?-pentamethoxy-
Common Name English
Code System Code Type Description
CAS
518-58-1
Created by admin on Tue Apr 01 19:43:10 GMT 2025 , Edited by admin on Tue Apr 01 19:43:10 GMT 2025
PRIMARY
NSC
255994
Created by admin on Tue Apr 01 19:43:10 GMT 2025 , Edited by admin on Tue Apr 01 19:43:10 GMT 2025
PRIMARY
PUBCHEM
5925916
Created by admin on Tue Apr 01 19:43:10 GMT 2025 , Edited by admin on Tue Apr 01 19:43:10 GMT 2025
PRIMARY
CAS
80405-09-0
Created by admin on Tue Apr 01 19:43:10 GMT 2025 , Edited by admin on Tue Apr 01 19:43:10 GMT 2025
NON-SPECIFIC STEREOCHEMISTRY
FDA UNII
7Y8622K9HX
Created by admin on Tue Apr 01 19:43:10 GMT 2025 , Edited by admin on Tue Apr 01 19:43:10 GMT 2025
PRIMARY