input word = C00042668

Metabolite InformationStructural formula
Name Lanceolitol B1
Formula C24H44O12
Mw 524.28327687
CAS RN 862699-50-1
C_ID C00042668 ,
InChIKey RSGPQSLXBAUYHJ-CVNQSZDVNA-N
InChICode InChI=1S/C25H46O12/c1-2-3-4-5-6-7-8-9-10-11-12-15(27)36-23-20(32)18(30)19(31)21(33)24(23)37-25-22(34)17(29)16(28)14(13-26)35-25/h14,16-26,28-34H,2-13H2,1H3/t14-,16+,17+,18-,19+,20-,21+,22-,23-,24+,25+/m1/s1
SMILES [C@H]1([C@@H]([C@@H]([C@@H]([C@@H]([C@@H]1OC(=O)CCCCCCCCCCCC)O[C@@H]1O[C@@H]([C@@H]([C@@H]([C@H]1O)O)O)CO)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeSolanum lanceolatum Ref.
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