input word = C00055109

Metabolite InformationStructural formula
Name Amritoside
Formula C26H26O18
Mw 626.11191403
CAS RN 2455-85-8
C_ID C00055109
InChIKey FHIYBTOOLROABN-YMLQNWNPSA-N
InChICode InChI=1S/C26H26O18/c27-3-9-14(30)17(33)19(35)25(41-9)39-4-10-15(31)18(34)20(36)26(42-10)40-8-2-6-12-11-5(23(37)44-22(12)16(8)32)1-7(28)13(29)21(11)43-24(6)38/h1-2,9-10,14-15,17-20,25-36H,3-4H2/t9-,10-,14-,15-,17+,18+,19-,20-,25-,26-/m1/s1
SMILES O=C(O1)C2=CC(O[C@@H]3O[C@H](CO[C@H]4[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O4)[C@@H](O)[C@H](O)[C@H]3O)=C(O)C5=C2C6=C1C(O)=C(O)C=C6C(O5)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMyrtaceaePsidium guajava Ref.
zoom in