input word = C00047106

Metabolite InformationStructural formula
Name Theopederin E
Formula C22H37NO9
Mw 459.24683179
CAS RN 141754-59-8
C_ID C00047106 ,
InChIKey OBDAALQFQJRDKI-JJNRUDBRNA-N
InChICode InChI=1S/C22H37NO9/c1-11-8-22(28-7,32-13(3)12(11)2)17(25)19(26)23-20-16-15(29-10-30-20)18(27-6)21(4,5)14(9-24)31-16/h12-18,20,24-25H,1,8-10H2,2-7H3,(H,23,26)/t12-,13-,14-,15+,16-,17-,18-,20+,22-/m1/s1
SMILES C=C1C[C@](OC)([C@H](O)C(=O)N[C@H]2OCO[C@H]3[C@@H]2O[C@H](CO)C(C)(C)[C@@H]3OC)O[C@H](C)[C@@H]1C
Start Substs in Alk. Biosynthesis (Prediction) Cholesterol
Organism
Kingdom Family Species Reference
--Stylinos n.sp. Ref.
--Theonella swinhoei Ref.
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OrganismTheonella swinhoei
Referencehttps://doi.org/10.1016/S0040-4020(99)00841-8