input word = C00038683

Metabolite InformationStructural formula
Name Calyceramide C
Formula C34H67NO7S
Mw 633.46382423
CAS RN 346425-31-8
C_ID C00038683 ,
InChIKey JHUJGQMYFPHVIU-UZHGQYAFNA-N
InChICode InChI=1S/C34H67NO7S/c1-4-5-6-7-8-9-10-11-12-15-18-21-24-27-32(36)31(29-42-43(39,40)41)35-34(38)33(37)28-25-22-19-16-13-14-17-20-23-26-30(2)3/h24,27,30-33,36-37H,4-23,25-26,28-29H2,1-3H3,(H,35,38)(H,39,40,41)/b27-24+/t31-,32+,33+/m0/s1
SMILES C(CCCCCCCCC/C=C/[C@H]([C@H](COS(=O)(=O)O)NC(=O)[C@@H](CCCCCCCCCCCC(C)C)O)O)CCC
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg L-Ala
Organism
Kingdom Family Species Reference
--Discodermia calyx Ref.
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