input word = C00048065

Metabolite InformationStructural formula
Name Pimelotide A
(+)-Pimelotide A
Formula C30H42O9
Mw 546.28288294
CAS RN 1202753-29-4
C_ID C00048065 ,
InChIKey XRYQMTUHMOLDGS-JQZCSLFCNA-N
InChICode InChI=1S/C30H42O9/c1-15(2)26-13-17(4)29-19-21(26)35-28(38-26,39-29)12-10-8-6-7-9-11-16(3)18-20(29)30(24(33)36-25(18,5)37-30)23(32)27(14-31)22(19)34-27/h16-23,31-32H,1,6-14H2,2-5H3/t16-,17+,18+,19+,20-,21+,22-,23+,25-,26+,27-,28+,29+,30-/m0/s1
SMILES [C@]123O[C@@]45[C@H]6[C@@]7([C@@H]([C@@]8([C@H]([C@H]4[C@H]([C@](C[C@H]5C)(O1)C(=C)C)O2)O8)CO)O)O[C@@]([C@@H]6[C@H](CCCCCCC3)C)(OC7=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeThymelaeaceaePimelea elongata Ref.
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