input word = C00043264

Metabolite InformationStructural formula
Name Amentol
Formula C27H38O5
Mw 442.27192432
CAS RN 111455-66-4
C_ID C00043264 ,
InChIKey NAGGUTLYHIBWFX-CAOOACKPNA-N
InChICode InChI=1S/C27H38O5/c1-17(8-9-19-14-20(28)13-18(2)23(19)30)12-21-15-25(5)10-7-11-26(25,6)27(31-21)16-22(29)24(3,4)32-27/h8,13-15,22,28-30H,7,9-12,16H2,1-6H3/b17-8+/t22-,25+,26-,27-/m1/s1
SMILES C1(=C[C@]2([C@]([C@]3(O1)OC([C@@H](C3)O)(C)C)(CCC2)C)C)C/C(=C/Cc1cc(cc(c1O)C)O)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AlgaeCystoseiraceaeCystoseira sp. Ref.
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OrganismCystoseira sp.
ReferenceNavarro,J.Nat.Prod.,67,(2004),495