input word = C00003084

Metabolite InformationStructural formula
Name Ipolamiide
Formula C17H26O11
Mw 406.14751167
CAS RN 27934-98-1
C_ID C00003084 ,
InChIKey RWMXKBUPLSNIJL-IWMKUFPHNA-N
InChICode InChI=1S/C17H26O11/c1-16(23)3-4-17(24)7(13(22)25-2)6-26-15(12(16)17)28-14-11(21)10(20)9(19)8(5-18)27-14/h6,8-12,14-15,18-21,23-24H,3-5H2,1-2H3/t8-,9-,10+,11-,12-,14+,15+,16+,17+/m1/s1
SMILES [C@@H]1([C@@H]([C@H]([C@@H](O[C@@H]1CO)O[C@@H]1OC=C([C@@]2([C@H]1[C@](CC2)(O)C)O)C(=O)OC)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAcanthaceaeBarleria lupulina Ref.
PlantaeLabiataeLamium amplexicaule Ref.
PlantaeLabiataePhlomis aurea Ref.
PlantaeVerbenaceaeStachytarpheta mutabilis Ref.
PlantaeVerbenaceaeVerbenoxylum reitzii Ref.
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OrganismBarleria lupulina
ReferenceKanchanapoom,Phytochem.,58,(2001),337