input word = C00049447

Metabolite InformationStructural formula
Name Dihydroxyfucotriphlorethol A tetradecaacetate
Formula C58H50O31
Mw 1242.23360489
CAS RN 189216-27-1
C_ID C00049447 ,
InChIKey FGXJIOOASAQJHC-UHFFFAOYSA-N
InChICode InChI=1S/C58H50O31/c1-23(59)73-37-15-40(74-24(2)60)50(41(16-37)75-25(3)61)51-42(76-26(4)62)21-47(81-31(9)67)54(57(51)85-35(13)71)87-38-19-45(79-29(7)65)53(46(20-38)80-30(8)66)89-49-22-48(82-32(10)68)55(84-34(12)70)58(86-36(14)72)56(49)88-39-17-43(77-27(5)63)52(83-33(11)69)44(18-39)78-28(6)64/h15-22H,1-14H3
SMILES c1(c(c(cc(c1)Oc1c(cc(c(c1OC(=O)C)c1c(cc(cc1OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)Oc1cc(c(c(c1Oc1cc(c(c(c1)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
ChromalveolataSargassaceaeCarpophyllum angustifolium Ref.
ChromalveolataSargassaceaeCystophora torulosa Ref.
ChromalveolataSargassaceaeSargassum spinuligerum Ref.
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