input word = C00031979

Metabolite InformationStructural formula
Name Linckiacerebroside A
(+)-Linckiacerebroside A
Formula C40H79NO10
Mw 733.57039775
CAS RN 872856-34-3
C_ID C00031979 ,
InChIKey FQYGQINELNMLPB-ZCTNICLJNA-N
InChICode InChI=1S/C40H79NO10/c1-4-5-6-7-8-9-10-11-14-18-21-24-27-33(44)39(49)41-31(29-50-40-38(48)37(47)36(46)34(28-42)51-40)35(45)32(43)26-23-20-17-15-12-13-16-19-22-25-30(2)3/h30-38,40,42-48H,4-29H2,1-3H3,(H,41,49)/t31-,32+,33+,34+,35-,36+,37-,38+,40+/m0/s1
SMILES [C@H]1([C@H]([C@@H]([C@H](O[C@H]1OC[C@H](NC(=O)[C@H](O)CCCCCCCCCCCCCC)[C@@H]([C@@H](CCCCCCCCCCCC(C)C)O)O)CO)O)O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg L-Ala
Organism
Kingdom Family Species Reference
AnimaliaOphidiasteridaeLinckia laevigata Ref.
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