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Details

Stereochemistry ABSOLUTE
Molecular Formula C56H42O12
Molecular Weight 906.9255
Optical Activity ( - )
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Hopeaphenol

SMILES

OC1=CC=C(C=C1)[C@@H]2OC3=C4[C@H]2C5=CC(O)=CC(O)=C5[C@H]([C@H]([C@H]6[C@H](C7=CC=C(O)C=C7)C8=C(O)C=C(O)C=C8[C@H]9[C@@H](OC%10=C9C6=CC(O)=C%10)C%11=CC=C(O)C=C%11)C4=CC(O)=C3)C%12=CC=C(O)C=C%12

InChI

InChIKey=YQQUILZPDYJDQJ-KGDQSQJYSA-N
InChI=1S/C56H42O12/c57-29-9-1-25(2-10-29)45-47-37(17-33(61)21-41(47)65)53-49-39(19-35(63)23-43(49)67-55(53)27-5-13-31(59)14-6-27)51(45)52-40-20-36(64)24-44-50(40)54(56(68-44)28-7-15-32(60)16-8-28)38-18-34(62)22-42(66)48(38)46(52)26-3-11-30(58)12-4-26/h1-24,45-46,51-66H/t45-,46-,51-,52-,53-,54-,55+,56+/m1/s1

HIDE SMILES / InChI

Molecular Formula C56H42O12
Molecular Weight 906.9255
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
8K2E6922LC
Record Status Validated (UNII)
Record Version