input word = C00016325

Metabolite InformationStructural formula
Name F 10863A
Squalene synthase inhibitor compd. A
Zaragozic acid D3
Formula C41H50O14
Mw 766.32005631
CAS RN 191474-81-4
C_ID C00016325 ,
InChIKey DAIUNLCLMAJMGY-OXNDGFJANA-N
InChICode InChI=1S/C41H50O14/c1-27(17-15-23-30-21-12-8-13-22-30)31(52-28(2)42)24-16-26-39-33(44)34(41(55-39,38(49)50)40(51,37(47)48)35(54-39)36(45)46)53-32(43)25-14-6-4-3-5-9-18-29-19-10-7-11-20-29/h7-13,15,18-23,27,31,33-35,44,51H,3-6,14,16-17,24-26H2,1-2H3,(H,45,46)(H,47,48)(H,49,50)/b18-9+,23-15+/t27-,31-,33-,34+,35-,39-,40-,41-/m0/s1
SMILES [C@@]12([C@@]([C@@H](O[C@@]([C@H]([C@H]1OC(=O)CCCCCC/C=C/c1ccccc1)O)(CCC[C@@H]([C@H](C/C=C/c1ccccc1)C)OC(=O)C)O2)C(=O)O)(O)C(=O)O)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiDermateaceaeMollisia sp. SANK 10294 Ref.
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