input word = C00008960

Metabolite InformationStructural formula
Name 8,12-Bis(2,4-dihydroxyphenyl)-6,10-bis(3,4-dihydroxyphenyl)-7,11-dihydroxy-7,8,11,12-tetrahydro-6H,10H-dipyrano[2,3-f:2',3'-h]catechin
Formula C45H38O16
Mw 834.21598517
CAS RN 102258-24-2
C_ID C00008960 ,
InChIKey UIKHFIDWMMHDLH-IROAKIDHNA-N
InChICode InChI=1S/C45H38O16/c46-20-4-6-22(28(51)14-20)34-36-43-24(16-33(56)40(59-43)17-1-8-25(48)30(53)11-17)44-37(45(36)61-42(39(34)58)19-3-10-27(50)32(55)13-19)35(23-7-5-21(47)15-29(23)52)38(57)41(60-44)18-2-9-26(49)31(54)12-18/h1-15,33-35,38-42,46-58H,16H2/t33-,34-,35-,38-,39-,40-,41+,42+/m0/s1
SMILES c12c(c3c(c4c1O[C@H]([C@H](C4)O)c1cc(c(cc1)O)O)O[C@@H]([C@H]([C@H]3c1ccc(cc1O)O)O)c1ccc(c(c1)O)O)O[C@@H]([C@H]([C@H]2c1ccc(cc1O)O)O)c1cc(c(cc1)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeColophospermum mopane Ref.
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