input word = C00041380

Metabolite InformationStructural formula
Name Bisfucopentaphlorethol-B nonadeca-acetate
Formula C86H72O43
Mw 1792.34473106
CAS RN 202211-25-4
C_ID C00041380 ,
InChIKey JJIWTGLJEPYVKK-UHFFFAOYSA-N
InChICode InChI=1S/C86H72O43/c1-35(87)106-54-20-55(107-36(2)88)22-56(21-54)125-80-72(128-81-68(117-46(12)98)29-60(30-69(81)118-47(13)99)126-83-74(121-50(16)102)33-66(115-44(10)96)78(85(83)123-52(18)104)76-62(111-40(6)92)23-57(108-37(3)89)24-63(76)112-41(7)93)27-59(110-39(5)91)28-73(80)129-82-70(119-48(14)100)31-61(32-71(82)120-49(15)101)127-84-75(122-51(17)103)34-67(116-45(11)97)79(86(84)124-53(19)105)77-64(113-42(8)94)25-58(109-38(4)90)26-65(77)114-43(9)95/h20-34H,1-19H3
SMILES c1(cc(cc(c1Oc1cc(cc(c1)OC(=O)C)OC(=O)C)Oc1c(cc(cc1OC(=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)OC(=O)C)OC(=O)C)Oc1c(cc(cc1OC(=O)C)Oc1c(c(c(cc1OC(=O)C)OC(=O)C)c1c(cc(cc1OC(=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
ChromalveolataSargassaceaeCystophora retroflexa Ref.
zoom in



OrganismCystophora retroflexa
ReferenceSailler,J.Nat.Prod.,69,(2006),869