input word = C00032125

Metabolite InformationStructural formula
Name Sinocrassoside A3
(-)-Sinocrassoside A3
Formula C29H32O16
Mw 636.16903498
CAS RN 909803-16-3
C_ID C00032125 ,
InChIKey QYNYDEUBBPFDDZ-VTAAKGAENA-N
InChICode InChI=1S/C29H32O16/c1-10-19(34)22(37)23(38)28(40-10)42-14-7-15(33)18-16(8-14)43-25(12-3-5-13(32)6-4-12)27(21(18)36)45-29-24(39)26(41-11(2)31)20(35)17(9-30)44-29/h3-8,10,17,19-20,22-24,26,28-30,32-35,37-39H,9H2,1-2H3/t10-,17+,19-,20+,22+,23+,24+,26-,28-,29-/m0/s1
SMILES CC(=O)O[C@@H]1[C@@H](O)[C@H](Oc2c(-c3ccc(O)cc3)oc3cc(O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)cc(O)c3c2=O)O[C@H](CO)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCrassulaceaeSinocrassula indica Ref.
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