input word = C00044579

Metabolite InformationStructural formula
Name Briarellin D
Formula C24H36O6
Mw 420.25118888
CAS RN 165171-24-4
C_ID C00044579 ,
InChIKey UCDUEWRTJNDUNP-UHFFFAOYNA-N
InChICode InChI=1S/C24H36O6/c1-6-7-18(26)29-23(4)10-8-15-14(3)22(27)30-24(5)11-9-16(25)13(2)12-17-20(23)19(15)21(24)28-17/h14-17,19-21,25H,2,6-12H2,1,3-5H3/t14-,15-,16+,17-,19+,20+,21-,23-,24-/m0/s1
SMILES C=C1CC2OC3C4C(CCC(C)(OC(=O)CCC)C24)C(C)C(=O)OC3(C)CCC1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Briareum polyanthes Ref.
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