input word = C00032130

Metabolite InformationStructural formula
Name Sinocrassoside A8
(-)-Sinocrassoside A8
Formula C37H46O21
Mw 826.25315854
CAS RN 909803-21-0
C_ID C00032130 ,
InChIKey CSYBRHUSDBRWOI-TWVYHEINNA-N
InChICode InChI=1S/C37H46O21/c1-12(2)34(50)56-33-31(57-35-28(48)26(46)23(43)19(10-38)54-35)22(42)13(3)51-37(33)52-16-8-17(41)21-18(9-16)53-30(14-4-6-15(40)7-5-14)32(25(21)45)58-36-29(49)27(47)24(44)20(11-39)55-36/h4-9,12-13,19-20,22-24,26-29,31,33,35-44,46-49H,10-11H2,1-3H3/t13-,19+,20+,22-,23+,24+,26-,27-,28+,29+,31+,33+,35-,36-,37-/m0/s1
SMILES CC(C)C(=O)O[C@H]1[C@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(-c4ccc(O)cc4)oc3c2)O[C@@H](C)[C@H](O)[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCrassulaceaeSinocrassula indica Ref.
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