input word = C00044262

Metabolite InformationStructural formula
Name Nahocol C
Formula C29H44O6
Mw 488.31378914
CAS RN 160262-44-2
C_ID C00044262 ,
InChIKey WEVNTXIBWFCWJZ-CIAFOILYNA-N
InChICode InChI=1S/C29H44O6/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/h8,12,14-15,17-18,22,25,28,30-31,33H,1,9-11,13,16,19H2,2-7H3/b21-12+/t22-,25-,28+,29+/m1/s1
SMILES C=CC(C)(CC/C=C(C)CCCC(C)C(O)C(O)C=C(C)C)Oc1ccc(O)cc1CC(=O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
ChromalveolataSargassaceaeSargassum autumnale Ref.
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