input word = C00041528

Metabolite InformationStructural formula
Name Fucotetraphlorethol-J tetradeca-acetate
Formula C64H54O32
Mw 1334.25981964
CAS RN 227085-40-7
C_ID C00041528 ,
InChIKey IZVROJUXWXJXMP-UHFFFAOYSA-N
InChICode InChI=1S/C64H54O32/c1-27(65)79-41-15-42(80-28(2)66)17-43(16-41)93-60-52(87-35(9)73)22-46(23-53(60)88-36(10)74)94-61-54(89-37(11)75)24-47(25-55(61)90-38(12)76)95-62-51(86-34(8)72)20-45(82-30(4)68)21-56(62)96-63-57(91-39(13)77)26-50(85-33(7)71)59(64(63)92-40(14)78)58-48(83-31(5)69)18-44(81-29(3)67)19-49(58)84-32(6)70/h15-26H,1-14H3
SMILES c1(c(cc(cc1OC(=O)C)OC(=O)C)Oc1c(cc(c(c1OC(=O)C)c1c(cc(cc1OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)Oc1cc(c(c(c1)OC(=O)C)Oc1cc(c(c(c1)OC(=O)C)Oc1cc(cc(OC(=O)C)c1)OC(=O)C)OC(=O)C)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
ChromalveolataSargassaceaeCystophora retroflexa Ref.
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OrganismCystophora retroflexa
ReferenceSailler,J.Nat.Prod.,69,(2006),869