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Details

Stereochemistry ACHIRAL
Molecular Formula C36H22O18
Molecular Weight 742.5491
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 8,8-BIECKOL

SMILES

OC1=CC(OC2=C3OC4=C(O)C(=C(O)C=C4OC3=C(O)C=C2O)C5=C(O)C=C6OC7=C(O)C=C(O)C(OC8=CC(O)=CC(O)=C8)=C7OC6=C5O)=CC(O)=C1

InChI

InChIKey=FHYNTHBAMAEFJB-UHFFFAOYSA-N
InChI=1S/C36H22O18/c37-11-1-12(38)4-15(3-11)49-29-19(43)7-21(45)31-35(29)53-33-23(51-31)9-17(41)25(27(33)47)26-18(42)10-24-34(28(26)48)54-36-30(20(44)8-22(46)32(36)52-24)50-16-5-13(39)2-14(40)6-16/h1-10,37-48H

HIDE SMILES / InChI

Molecular Formula C36H22O18
Molecular Weight 742.5491
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
7J2CFB3NBV
Record Status Validated (UNII)
Record Version