input word = C00048766

Metabolite InformationStructural formula
Name Marinoid A
(-)-Marinoid A
Formula C25H30O11
Mw 506.1788118
CAS RN 1048964-49-3
C_ID C00048766 ,
InChIKey BIZBWPKKEHPFMI-LDWDIXRLNA-N
InChICode InChI=1S/C25H30O11/c1-25(32)10-9-14-15(22(30)31)12-33-23(18(14)25)36-24-21(20(29)19(28)16(11-26)34-24)35-17(27)8-7-13-5-3-2-4-6-13/h2-8,12,14,16,18-21,23-24,26,28-29,32H,9-11H2,1H3,(H,30,31)/b8-7+/t14-,16-,18-,19-,20+,21-,23+,24+,25-/m1/s1
SMILES O1C=C([C@@H]2[C@H]([C@@H]1O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1OC(=O)/C=C/c1ccccc1)O)O)CO)[C@](CC2)(C)O)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAcanthaceaeAvicennia marina Ref.
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OrganismAvicennia marina
ReferenceBlunt,Nat.Prod.Rep.,27,(2010),165