input word = C00022198

Metabolite InformationStructural formula
Name Laurencianol
Formula C20H35Br2ClO3
Mw 516.06414849
CAS RN 84323-26-2
C_ID C00022198 ,
InChIKey LSOZDDIWYCQPCC-POLRWHBMNA-N
InChICode InChI=1S/C20H35Br2ClO3/c1-17(2)13(18(3,25)9-7-14(17)21)6-10-19(4)15(22)8-11-20(5,26-19)16(24)12-23/h13-16,24-25H,6-12H2,1-5H3/t13-,14-,15-,16-,18-,19+,20+/m1/s1
SMILES C1[C@H](C([C@H]([C@](C1)(C)O)CC[C@]1([C@@H](CC[C@](O1)([C@@H](CCl)O)C)Br)C)(C)C)Br
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Laurencia obtusa Ref.
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