input word = C00032819

Metabolite InformationStructural formula
Name Cilistol j
(-)-Cilistol j
Formula C34H56O11
Mw 640.38226263
CAS RN 331965-10-7
C_ID C00032819 ,
InChIKey RLRLTAGUIXFIHJ-HCGFYJIKNA-N
InChICode InChI=1S/C34H56O11/c1-16(23-14-32(3,41)34(5,42)30(44-23)45-29-28(40)27(39)26(38)24(15-35)43-29)20-8-9-21-19-7-6-17-12-18(36)13-25(37)33(17,4)22(19)10-11-31(20,21)2/h6,16,18-30,35-42H,7-15H2,1-5H3/t16-,18+,19-,20+,21-,22-,23+,24+,25-,26+,27-,28+,29-,30-,31-,32+,33-,34+/m0/s1
SMILES C[C@@H]([C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)C[C@H](O)[C@]4(C)[C@H]3CC[C@]12C)[C@H]1C[C@@](C)(O)[C@](C)(O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeSolanum cilistum Ref.
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OrganismSolanum cilistum
ReferenceZhu,Chem.Pharm.Bull.,49,(2001),161