input word = C00028575

Metabolite InformationStructural formula
Name Mer-WF-1726
Formula C29H35NO8
Mw 525.2362671
CAS RN 207679-46-7
C_ID C00028575 ,
InChIKey LVWIBRGJAUUGDB-MWOLTELDNA-N
InChICode InChI=1S/C29H35NO8/c1-16-7-6-8-20-24-28(4,37-24)17(2)22-21(15-18-9-11-19(35-5)12-10-18)30-25(32)29(20,22)38-26(33)36-14-13-27(3,34)23(16)31/h6,8-14,16-17,20-22,24,34H,7,15H2,1-5H3,(H,30,32)/b8-6+,14-13+/t16-,17-,20-,21-,22-,24-,27+,28+,29+/m0/s1
SMILES COc1ccc(C[C@@H]2NC(=O)[C@@]34OC(=O)O/C=C/[C@@](C)(O)C(=O)[C@@H](C)C/C=C/[C@H]3[C@@H]3O[C@]3(C)[C@@H](C)[C@@H]24)cc1
Start Substs in Alk. Biosynthesis (Prediction) L-Trp L-Tyr
Organism
Kingdom Family Species Reference
--Libertella sp. Ref.
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