input word = C00041817

Metabolite InformationStructural formula
Name Sagittine E
(-)-Sagittine E
Formula C29H44O7
Mw 504.30870376
CAS RN 878158-00-0
C_ID C00041817 ,
InChIKey OCJCDEIWDLGIQG-WYKFPGSXNA-N
InChICode InChI=1S/C29H44O7/c1-7-27(4)13-14-29(6)20(15-27)10-11-21-22(29)9-8-12-28(21,5)17-34-26-25(35-19(3)31)24(32)23(36-26)16-33-18(2)30/h7,11,20,22-26,32H,1,8-10,12-17H2,2-6H3/t20-,22-,23-,24+,25-,26+,27-,28+,29-/m0/s1
SMILES C1[C@H]2C(=CC[C@@H]3[C@@]2(CC[C@@](C3)(C=C)C)C)[C@](CC1)(CO[C@H]1[C@H]([C@@H]([C@@H](O1)COC(=O)C)O)OC(=O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAlismataceaeSagittaria sagittifolia Ref.
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OrganismSagittaria sagittifolia
ReferenceLiu,J.Nat.Prod.,69,(2006),255