input word = C00058573

Metabolite InformationStructural formula
Name Leachianol C
Formula C56H44O12
Mw 908.28327687
CAS RN 159359-65-6
C_ID C00058573
InChIKey JQNFXJDPHLTQHS-UHFFFAOYSA-N
InChICode InChI=1S/C56H44O12/c57-29-7-1-24(2-8-29)41-45-38(21-37(65)23-40(45)66)46-42(25-3-9-30(58)10-4-25)50-49(48(41)46)51-53-44(28-17-35(63)20-36(64)18-28)43(27-15-33(61)19-34(62)16-27)52(26-5-11-31(59)12-6-26)56(53)14-13-32(60)22-39(56)47(54(50)67)55(51)68/h1-21,23,39,41-44,46-48,51-53,57-59,61-66H,22H2
SMILES O=C1C=CC23C(C1)C1C(=O)C4=C(C(C1=O)C2C(c1cc(O)cc(O)c1)C(c1cc(O)cc(O)c1)C3c1ccc(O)cc1)C1C(c2ccc(O)cc2)c2c(O)cc(O)cc2C1C4c1ccc(O)cc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeSophora leachiana Ref.
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