input word = C00040372

Metabolite InformationStructural formula
Name Stachysoside F
(-)-Stachysoside F
Formula C30H38O17
Mw 670.21089979
CAS RN 1054473-05-0
C_ID C00040372 ,
InChIKey NCNSYPDKZHQEGY-BXUDOFHTNA-N
InChICode InChI=1S/C30H38O17/c31-10-14-9-18(35)30(7-8-42-27(20(14)30)46-28-24(40)23(39)21(37)16(11-32)43-28)47-29-25(41)26(22(38)17(12-33)44-29)45-19(36)6-3-13-1-4-15(34)5-2-13/h1-9,16-18,20-29,31-35,37-41H,10-12H2/b6-3-/t16-,17-,18-,20+,21-,22-,23+,24-,25-,26+,27+,28+,29+,30+/m1/s1
SMILES O1C=C[C@]2([C@H]([C@@H]1O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)C(=C[C@H]2O)CO)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)OC(=O)/C=C\c1ccc(cc1)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeStachys lanata Ref.
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OrganismStachys lanata
ReferenceMurata,J.Nat.Prod.,71,(2008),1768