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Details

Stereochemistry ACHIRAL
Molecular Formula C18H12O8
Molecular Weight 356.2831
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of Xerocomic acid

SMILES

OC(=O)C(=C1\OC(=O)C(=C1O)C2=CC=C(O)C(O)=C2)\C3=CC=C(O)C=C3

InChI

InChIKey=LJVSOLKVNIGBDE-JQIJEIRASA-N
InChI=1S/C18H12O8/c19-10-4-1-8(2-5-10)14(17(23)24)16-15(22)13(18(25)26-16)9-3-6-11(20)12(21)7-9/h1-7,19-22H,(H,23,24)/b16-14+

HIDE SMILES / InChI

Molecular Formula C18H12O8
Molecular Weight 356.2831
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
A8AF7UK664
Record Status Validated (UNII)
Record Version