input word = C00032820

Metabolite InformationStructural formula
Name Cilistol t
(-)-Cilistol t
Formula C34H54O10
Mw 622.37169795
CAS RN 331965-08-3
C_ID C00032820 ,
InChIKey MNFQTDOKETXTKR-HHLWFPLFNA-N
InChICode InChI=1S/C34H54O10/c1-16(23-14-32(3)34(5,44-32)30(42-23)43-29-28(40)27(39)26(38)24(15-35)41-29)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/h6,16,18-30,35-40H,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 C1[C@@H](CC2=CC[C@@H]3[C@@H]([C@]2([C@H]1O)C)CC[C@@]1([C@H]3CC[C@@H]1[C@@H]([C@H]1C[C@]2([C@]([C@@H](O1)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)(C)O2)C)C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeSolanum cilistum Ref.
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