input word = C00011933

Metabolite InformationStructural formula
Name Conyaegyptin
Formula C35H54O7
Mw 586.38695408
CAS RN 132536-54-0
C_ID C00011933 ,
InChIKey JTPNAVNBDHZIJG-OABXRWPDNA-N
InChICode InChI=1S/C35H54O7/c1-23(2)28-17-13-26(14-18-28)12-8-10-25(4)33(38)42-30-22-41-34(32(37)31(30)36)40-21-24(3)9-7-11-27-15-19-29(20-16-27)35(5,6)39/h10,13-15,17-18,23-24,29-32,34,36-37,39H,7-9,11-12,16,19-22H2,1-6H3/b25-10+/t24-,29+,30+,31+,32+,34-/m1/s1
SMILES [C@H]1([C@@H]([C@@H]([C@@H](OC1)OC[C@H](C)CCCC1=CC[C@@H](CC1)C(C)(C)O)O)O)OC(=O)/C(=C/CCc1ccc(cc1)C(C)C)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeConyza aegyptica Ref.
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