input word = C00039563

Metabolite InformationStructural formula
Name Kolokoside C
(-)-Kolokoside C
Formula C36H58O10
Mw 650.40299807
CAS RN 932034-66-7
C_ID C00039563 ,
InChIKey LZBTXWQJIPJEOU-QQIWIXIFNA-N
InChICode InChI=1S/C36H58O10/c1-17(2)20-13-25(40)45-31-34(6)12-11-18-19(35(34,7)15-24(39)36(20,31)8)9-10-23-32(3,4)29(21(38)14-33(18,23)5)46-30-28(43)27(42)26(41)22(16-37)44-30/h11,17,19-24,26-31,37-39,41-43H,9-10,12-16H2,1-8H3/t19-,20+,21+,22+,23+,24+,26+,27-,28+,29+,30-,31-,33+,34-,35+,36-/m0/s1
SMILES CC(C)[C@H]1CC(=O)O[C@@H]2[C@]1(C)[C@H](O)C[C@]1(C)[C@H]3CC[C@H]4C(C)(C)[C@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@H](O)C[C@]4(C)C3=CC[C@@]21C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiXylariaceaeXylaria sp. Ref.
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OrganismXylaria sp.
ReferenceDeyrup,J.Nat.Prod.,70,(2007),378