input word = C00032139

Metabolite InformationStructural formula
Name Sinocrassoside D2
(+)-Sinocrassoside D2
Formula C27H30O17
Mw 626.14829954
CAS RN 909803-33-4
C_ID C00032139 ,
InChIKey BXSLICKAYHSSIR-QHNUACQANA-N
InChICode InChI=1S/C27H30O17/c1-7-15(32)19(36)21(38)26(40-7)41-12-5-11(31)14-18(35)25(44-27-22(39)20(37)16(33)13(6-28)42-27)23(43-24(14)17(12)34)8-2-3-9(29)10(30)4-8/h2-5,7,13,15-16,19-22,26-34,36-39H,6H2,1H3/t7-,13+,15-,16+,19+,20-,21+,22+,26-,27-/m0/s1
SMILES O(c1cc(c2c(c1O)oc(c(c2=O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)c1ccc(c(c1)O)O)O)[C@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)C)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCrassulaceaeSinocrassula indica Ref.
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