input word = C00044623

Metabolite InformationStructural formula
Name Cerebroside D
Formula C43H81NO9
Mw 755.59113319
CAS RN 113773-89-0
C_ID C00044623 ,
InChIKey RIZIAUKTHDLMQX-OHYSOYKKNA-N
InChICode InChI=1S/C43H81NO9/c1-4-6-8-10-12-13-14-15-16-17-18-20-22-26-31-37(47)42(51)44-35(33-52-43-41(50)40(49)39(48)38(32-45)53-43)36(46)30-27-23-25-29-34(3)28-24-21-19-11-9-7-5-2/h27,29-30,35-41,43,45-50H,4-26,28,31-33H2,1-3H3,(H,44,51)/b30-27+,34-29+/t35-,36+,37+,38+,39+,40-,41+,43+/m0/s1
SMILES [C@H]1([C@H]([C@@H]([C@H](O[C@H]1OC[C@@H]([C@@H](/C=C/CC/C=C(/CCCCCCCCC)\C)O)NC(=O)[C@@H](CCCCCCCCCCCCCCCC)O)CO)O)O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg L-Ala
Organism
Kingdom Family Species Reference
FungiTricholomataceaeCatathelasma ventricosa Ref.
--Lactarium volemus Ref.
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