input word = C00042447

Metabolite InformationStructural formula
Name Daedaleaside E
(+)-Daedaleaside E
Formula C41H62O11
Mw 730.42921282
CAS RN 861399-72-6
C_ID C00042447 ,
InChIKey RUAKGNYESYUQPT-NCNPCTCCNA-N
InChICode InChI=1S/C41H62O11/c1-21(2)22(3)11-12-25(36(48)52-37-35(47)34(46)33(45)29(51-37)20-49-23(4)42)32-28(50-24(5)43)19-41(10)27-13-14-30-38(6,7)31(44)16-17-39(30,8)26(27)15-18-40(32,41)9/h21,25,28-30,32-35,37,45-47H,3,11-20H2,1-2,4-10H3/t25-,28-,29-,30+,32+,33-,34+,35-,37+,39-,40-,41+/m1/s1
SMILES C1C2=C([C@]3([C@](C1)([C@H]([C@@H](C3)OC(=O)C)[C@@H](CCC(=C)C(C)C)C(=O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COC(=O)C)O)O)O)C)C)CC[C@@H]1[C@@]2(CCC(=O)C1(C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiFomitopsidaceaeDaedalea dickinsii Ref.
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