input word = C00014542

Metabolite InformationStructural formula
Name Lophiroflavan C
Formula C60H50O15
Mw 1010.31497093
CAS RN 145107-55-7
C_ID C00014542 ,
InChIKey SZANJVUUZYJUNX-HXIWSZQDNA-N
InChICode InChI=1S/C60H50O15/c61-33-9-1-29(2-10-33)23-45-52(55(72)41-21-18-38(66)25-47(41)69)56(30-3-11-34(62)12-4-30)74-59(45)44-27-43(48(70)28-49(44)71)51(40-20-17-37(65)24-46(40)68)53-54-58(32-7-15-36(64)16-8-32)73-50-26-39(67)19-22-42(50)60(54)75-57(53)31-5-13-35(63)14-6-31/h1-22,24-28,45,51-54,56-71H,23H2/t45-,51+,52-,53+,54-,56+,57-,58-,59-,60+/m0/s1
SMILES O=C(c1ccc(O)cc1O)[C@H]1C(c2ccc(O)cc2)O[C@@H](c2cc([C@@H](c3ccc(O)cc3O)[C@@H]3[C@@H]4[C@H](O[C@H]3c3ccc(O)cc3)c3ccc(O)cc3O[C@H]4c3ccc(O)cc3)c(O)cc2O)[C@@H]1Cc1ccc(O)cc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOchnaceaeLophira alata Ref.
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OrganismLophira alata
ReferenceTih,Phytochem.,31,(1992),3595