input word = C00010960

Metabolite InformationStructural formula
Name Schizonepetoside A
Formula C16H26O7
Mw 330.16785319
CAS RN 78887-75-9
C_ID C00010960 ,
InChIKey CMULNSPKSRFQAF-YVOFEUQDNA-N
InChICode InChI=1S/C16H26O7/c1-8-3-4-10(11(18)5-8)9(2)7-22-16-15(21)14(20)13(19)12(6-17)23-16/h7-8,10,12-17,19-21H,3-6H2,1-2H3/b9-7+/t8-,10-,12+,13+,14-,15+,16+/m0/s1
SMILES C1C[C@H](C(=O)C[C@H]1C)/C(=C/O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeSchizonepeta tenuifolia Ref.
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OrganismSchizonepeta tenuifolia
ReferenceSasaki,Chem.Pharm.Bull.,29,(1981),1636