input word = C00041117

Metabolite InformationStructural formula
Name Scutalpin F
Formula C26H36O10
Mw 508.23084737
CAS RN 155662-28-5
C_ID C00041117 ,
InChIKey VQKBYMQKRVMNCA-UHFFFAOYNA-N
InChICode InChI=1S/C26H36O10/c1-15(27)31-14-26-18(7-6-8-25(26)13-33-25)22(4)9-10-24(11-19(30)32-12-24)36-23(22,5)20(34-16(2)28)21(26)35-17(3)29/h18,20-21H,6-14H2,1-5H3/t18-,20+,21+,22-,23-,24+,25-,26+/m1/s1
SMILES CC(=O)OCC12C(OC(C)=O)C(OC(C)=O)C3(C)OC4(CCC3(C)C1CCCC21CO1)COC(=O)C4
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeScutellaria alpina Ref.
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OrganismScutellaria alpina
ReferenceMallakov,Phytochem.,49,(1998),2449