Description
(+)-Hopeaphenol is a natural product found in Vitis chunganensis and Dipterocarpus grandiflorus.
Synonyms
[6,6'-Bibenzo[6,7]cyclohepta[1,2,3-cd]benzofuran]-4,4',8,8',10,10'-hexol, 1,1',6,6',7,7',11b,11'b-octahydro-1,1',7,7'-tetrakis(4-hydroxyphenyl)-, (1S,1'S,6R,6'R,7S,7'S,11bS,11'bS)-; (+)-Hopeaphenol; (1S,1'S,6R,6'R,7S,7'S,11bS,11b'S)-1,1',7,7'-Tetrakis(4-hydroxyphenyl)-1,1',6,6',7,7',11b,11b'-octahydro-6,6'-bi-2-oxadibenzo[cd,h]azulene-4,4',8,8',10,10'-hexol
IUPAC Name
(1S,8S,9R,16S)-8,16-bis(4-hydroxyphenyl)-9-[(1S,8S,9R,16S)-4,6,12-trihydroxy-8,16-bis(4-hydroxyphenyl)-15-oxatetracyclo[8.6.1.02,7.014,17]heptadeca-2(7),3,5,10(17),11,13-hexaen-9-yl]-15-oxatetracyclo[8.6.1.02,7.014,17]heptadeca-2(7),3,5,10(17),11,13-hexaene-4,6,12-triol
Molecular Formula
C56H42O12
Canonical SMILES
OC1=CC=C(C=C1)C2OC3=CC(O)=CC4=C3C2C=5C=C(O)C=C(O)C5C(C6=CC=C(O)C=C6)C4C7C=8C=C(O)C=C9OC(C%10=CC=C(O)C=C%10)C(C=%11C=C(O)C=C(O)C%11C7C%12=CC=C(O)C=C%12)C98
InChI
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+/m0/s1
InChIKey
YQQUILZPDYJDQJ-QWJFNKQSSA-N
Density
1.531±0.06 g/cm3 (Predicted)
Solubility
Soluble in Acetone, Chloroform, Dichloromethane, DMSO, Ethyl Acetate