input word = C00047283

Metabolite InformationStructural formula
Name Lespecyrtin H1
(-)-Lespecyrtin H1
Formula C50H54O9
Mw 798.37678332
CAS RN 1103684-16-7
C_ID C00047283 ,
InChIKey ACAJJERRPMQMTK-HVWWSGIMNA-N
InChICode InChI=1S/C50H54O9/c1-25(2)9-13-29-17-37(42(53)22-40(29)51)49-34(36-21-43(54)46(56)33(48(36)58-49)16-12-28(7)8)19-31-20-35-39-24-57-44-23-41(52)30(14-10-26(3)4)18-38(44)50(39)59-47(35)32(45(31)55)15-11-27(5)6/h9-12,17-18,20-23,39,50-56H,13-16,19,24H2,1-8H3/t39-,50-/m0/s1
SMILES [C@@H]12[C@@H](COc3c1cc(c(c3)O)CC=C(C)C)c1c(O2)c(c(c(c1)Cc1c2c(oc1c1cc(c(cc1O)O)CC=C(C)C)c(c(c(c2)O)O)CC=C(C)C)O)CC=C(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeLespedeza cyrtobotrya Ref.
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