input word = C00042957

Metabolite InformationStructural formula
Name Sargachromanol K
Formula C27H38O4
Mw 426.2770097
CAS RN 856414-60-3
C_ID C00042957 ,
InChIKey GMQYRVFAOONCKK-HFXNWSDSNA-N
InChICode InChI=1S/C27H38O4/c1-18(2)15-24(29)25(30)20(4)11-7-9-19(3)10-8-13-27(6)14-12-22-17-23(28)16-21(5)26(22)31-27/h10-11,15-17,25,28,30H,7-9,12-14H2,1-6H3/b19-10+,20-11+/t25-,27+/m0/s1
SMILES c1c(cc2c(c1C)O[C@@](CC2)(CC/C=C(/CC/C=C(/[C@@H](C(=O)C=C(C)C)O)\C)\C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
ChromalveolataSargassaceaeSargassum siliquastrum Ref.
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