input word = C00043694

Metabolite InformationStructural formula
Name Manoalide 25-acetate
Formula C27H38O6
Mw 458.26683895
CAS RN 75088-81-2
C_ID C00043694 ,
InChIKey IBDCHSSSHBQBDQ-ZKIUXHNFNA-N
InChICode InChI=1S/C27H38O6/c1-17(11-13-22-18(2)9-7-15-27(22,4)5)8-6-10-20-12-14-23(32-25(20)30)21-16-24(29)33-26(21)31-19(3)28/h8,12,16,23,25-26,30H,6-7,9-11,13-15H2,1-5H3/b17-8+/t23-,25-,26+/m1/s1
SMILES C1(=C(CCCC1(C)C)C)CC/C(=C/CCC1=CC[C@@H](O[C@H]1O)C1=CC(=O)O[C@@H]1OC(=O)C)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Brachiaster sp. Ref.
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OrganismBrachiaster sp.
ReferenceWonganuchitmeta,J.Nat.Prod.,67,(2004),1767