input word = C00046171

Metabolite InformationStructural formula
Name Muqubilin
Formula C24H40O4
Mw 392.29265977
CAS RN 72154-33-7
C_ID C00046171 ,
InChIKey ZJKZMXQQSDVDLA-BMXWEILYNA-N
InChICode InChI=1S/C24H40O4/c1-17(11-12-20-18(2)10-8-14-23(20,4)5)9-7-15-24(6)16-13-21(27-28-24)19(3)22(25)26/h9,19,21H,7-8,10-16H2,1-6H3,(H,25,26)/b17-9+/t19-,21+,24+/m1/s1
SMILES C1CCC(=C(C1(C)C)CC/C(=C/CC[C@]1(CC[C@H](OO1)[C@H](C(=O)O)C)C)/C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Diacarnus erythraenus Ref.
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