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Details

Stereochemistry ACHIRAL
Molecular Formula C16H14O8
Molecular Weight 334.2776
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BARCELONEIC ACID B

SMILES

COC1=CC(O)=C(OC2=CC(C)=CC(O)=C2C(O)=O)C(=C1)C(O)=O

InChI

InChIKey=BMKJMWKTRHWAPN-UHFFFAOYSA-N
InChI=1S/C16H14O8/c1-7-3-10(17)13(16(21)22)12(4-7)24-14-9(15(19)20)5-8(23-2)6-11(14)18/h3-6,17-18H,1-2H3,(H,19,20)(H,21,22)

HIDE SMILES / InChI

Molecular Formula C16H14O8
Molecular Weight 334.2776
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
Y5F92XBQ7Y
Record Status Validated (UNII)
Record Version