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Details

Stereochemistry ACHIRAL
Molecular Formula C15H12O5
Molecular Weight 272.2528
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of BUTEIN

SMILES

OC1=CC=C(C(=O)\C=C\C2=CC=C(O)C(O)=C2)C(O)=C1

InChI

InChIKey=AYMYWHCQALZEGT-ORCRQEGFSA-N
InChI=1S/C15H12O5/c16-10-3-4-11(14(19)8-10)12(17)5-1-9-2-6-13(18)15(20)7-9/h1-8,16,18-20H/b5-1+

HIDE SMILES / InChI

Molecular Formula C15H12O5
Molecular Weight 272.2528
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
4WVS5M0LGF
Record Status Validated (UNII)
Record Version