input word = C00039819

Metabolite InformationStructural formula
Name Nahocol A
Formula C29H42O6
Mw 486.29813907
CAS RN 160262-42-0
C_ID C00039819 ,
InChIKey KXTOXZSIGCDGHF-CIAFOILYNA-N
InChICode InChI=1S/C29H42O6/c1-8-29(6,35-26-15-14-24(30)18-23(26)19-27(32)34-7)16-10-12-21(4)11-9-13-22(5)28(33)25(31)17-20(2)3/h8,12,14-15,17-18,22,25,30-31H,1,9-11,13,16,19H2,2-7H3/b21-12+/t22-,25-,29+/m0/s1
SMILES c1cc(cc(c1O[C@@](CC/C=C(\C)/CCC[C@H](C)C(=O)[C@H](C=C(C)C)O)(C=C)C)CC(=O)OC)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
ChromalveolataSargassaceaeSargassum autumnale Ref.
ChromalveolataSargassaceaeSargassum siliquastrum Ref.
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