input word = C00047050

Metabolite InformationStructural formula
Name Haliclonyne
Formula C47H72O11
Mw 812.50746314
CAS RN 264265-85-2
C_ID C00047050 ,
InChIKey YINBTZARCUUZAE-CEASRFAGNA-N
InChICode InChI=1S/C47H72O11/c1-2-38(48)34-35-43(53)30-22-21-29-42(52)32-23-31-41(51)28-20-19-27-40(50)26-16-12-9-7-5-3-4-6-8-11-15-24-39(49)25-17-13-10-14-18-33-44(54)47(58)45(55)36-37-46(56)57/h1,16,26,34-35,38,40-45,47-48,50-55,58H,3-15,17-19,21-22,24-25,27,29-30,32-33H2,(H,56,57)/b26-16+,35-34+/t38-,40-,41+,42+,43-,44+,45-,47+/m0/s1
SMILES C(=O)(C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaChalinidaeHaliclona sp. Ref.
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OrganismHaliclona sp.
ReferenceChill,J.Nat.Prod.,63,(2000),523