CAS: 152378-18-2 - Selligueain A

Formula:C₄₅H₃₆O₁₅

InChI:InChI=1S/C45H36O15/c46-21-7-1-18(2-8-21)40-30(54)15-25-26(50)16-28(52)34(42(25)57-40)37-35-29(53)17-32-36(43(35)58-41(39(37)55)19-3-9-22(47)10-4-19)38-33-27(51)13-24(49)14-31(33)59-45(60-32,44(38)56)20-5-11-23(48)12-6-20/h1-14,16-17,30,37-41,44,46-56H,15H2/t30-,37-,38+,39+,40+,41+,44+,45-/m0/s1

InChI key:InChIKey=PMDYNLFGCCRGRX-HMQYECKYSA-N

SMILES:OC1=CC=C(C=C1)C2OC=3C(=C(O)C=C(O)C3C4C5=C(O)C=C6OC7(OC=8C=C(O)C=C(O)C8C(C6=C5OC(C9=CC=C(O)C=C9)C4O)C7O)C%10=CC=C(O)C=C%10)CC2O

Synonyms:
8,14-Methano-2H,14H-1-benzopyrano[7,8-d][1,3]benzodioxocin-3,5,11,13,15-pentol, 4-[(2R,3S)-3,4-dihydro-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-2H-1-benzopyran-8-yl]-3,4-dihydro-2,8-bis(4-hydroxyphenyl)-, (2R,3R,4S,8S,14R,15R)-
Selligueain A
(2R,3R,4S,8S,14R,15R)-4-[(2R,3S)-3,4-Dihydro-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-2H-1-benzopyran-8-yl]-3,4-dihydro-2,8-bis(4-hydroxyphenyl)-8,14-methano-2H,14H-1-benzopyrano[7,8-d][1,3]benzodioxocin-3,5,11,13,15-pentol
8,14-Methano-2H,14H-1-benzopyrano[7,8-d][1,3]benzodioxocin-3,5,11,13,15-pentol, 4-[3,4-dihydro-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-2H-1-benzopyran-8-yl]-3,4-dihydro-2,8-bis(4-hydroxyphenyl)-, [2R-[2α,3α,4β(2R*,3S*),8β,14β,15R*]]-
Selligueain