input word = C00042664

Metabolite InformationStructural formula
Name Lanceolitol A4
Formula C27H50O11
Mw 550.33531244
CAS RN 862699-43-2
C_ID C00042664 ,
InChIKey WKITYCPAMPCPHX-NUSQOANGNA-N
InChICode InChI=1S/C27H50O11/c1-3-4-9-12-16(2)13-10-7-5-6-8-11-14-18(29)37-25-22(33)20(31)21(32)23(34)26(25)38-27-24(35)19(30)17(28)15-36-27/h16-17,19-28,30-35H,3-15H2,1-2H3/t16-,17-,19+,20+,21-,22+,23-,24-,25-,26-,27+/m1/s1
SMILES [C@@H]1([C@H]([C@H]([C@H]([C@H]([C@@H]1OC(=O)CCCCCCCC[C@@H](CCCCC)C)O[C@@H]1OC[C@H]([C@@H]([C@H]1O)O)O)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeSolanum lanceolatum Ref.
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