input word = C00015806

Metabolite InformationStructural formula
Name Macrophylloside A
Formula C24H28O11
Mw 492.16316174
CAS RN 113270-95-4
C_ID C00015806 ,
InChIKey MJWZLKCDHYQYPT-FTBFHBSZNA-N
InChICode InChI=1S/C24H28O11/c1-30-15-8-12(9-16(31-2)22(15)32-3)14-7-11-5-4-6-13(18(11)23(29)33-14)34-24-21(28)20(27)19(26)17(10-25)35-24/h4-6,8-9,14,17,19-21,24-28H,7,10H2,1-3H3/t14-,17-,19-,20+,21-,24-/m1/s1
SMILES c1(c(c(cc(c1)[C@H]1Cc2cccc(c2C(=O)O1)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)OC)OC)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeGentianaceaeGentiana straminea Ref.
PlantaeGentianaceaeGentiana tibetica Ref.
PlantaeHydrangeaceaeHydrangea macrophylla subsp.serrata Ref.
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OrganismGentiana tibetica
ReferenceTan, et al., Phytochemistry, 47, (1998), 1223