input word = C00040978

Metabolite InformationStructural formula
Name Glabcensin O
(-)-Glabcensin O
Formula C29H42O11
Mw 566.27271219
CAS RN 196607-60-0
C_ID C00040978 ,
InChIKey GEBGPSOVDACJMU-DHXBIMLJNA-N
InChICode InChI=1S/C29H42O11/c1-13(30)37-19-9-17-10-29(24(34)18(17)12-36-8)22(19)28(7)11-20(38-14(2)31)26(40-16(4)33)27(5,6)23(28)21(25(29)35)39-15(3)32/h17-23,25-26,35H,9-12H2,1-8H3/t17-,18-,19+,20+,21-,22+,23-,25+,26+,28+,29+/m1/s1
SMILES [C@H]1([C@@H](C([C@@H]2[C@@](C1)([C@H]1[C@@]3([C@H]([C@@H]2OC(=O)C)O)C[C@@H](C[C@@H]1OC(=O)C)[C@H](C3=O)COC)C)(C)C)OC(=O)C)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon angustifolius var. glabrescens Ref.
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