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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
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
7Y8622K9HX
Record Status Validated (UNII)
Record Version