input word = C00040373

Metabolite InformationStructural formula
Name Stachysoside G
(-)-Stachysoside G
Formula C30H38O17
Mw 670.21089979
CAS RN 1054473-11-8
C_ID C00040373 ,
InChIKey OKFCVICEPQRZSV-PFVTUWJJNA-N
InChICode InChI=1S/C30H38O17/c31-10-14-9-18(34)30(7-8-42-27(20(14)30)46-28-25(40)23(38)21(36)16(11-32)44-28)47-29-26(41)24(39)22(37)17(45-29)12-43-19(35)6-3-13-1-4-15(33)5-2-13/h1-9,16-18,20-29,31-34,36-41H,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)COC(=O)/C=C/c1ccc(cc1)O)O)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