input word = C00040972

Metabolite InformationStructural formula
Name Glabcensin I
(-)-Glabcensin I
Formula C24H34O8
Mw 450.22536806
CAS RN 196607-53-1
C_ID C00040972 ,
InChIKey IXDGFVDXAZOVQC-UTDCBIDWNA-N
InChICode InChI=1S/C24H34O8/c1-10-13-7-14(27)17-23(6)9-15(28)20(31-11(2)25)22(4,5)18(23)16(29)21(32-12(3)26)24(17,8-13)19(10)30/h13-18,20-21,27-29H,1,7-9H2,2-6H3/t13-,14+,15+,16-,17+,18-,20+,21+,23-,24+/m1/s1
SMILES [C@H]1([C@@H](C([C@@H]2[C@](C1)([C@H]1[C@@]3([C@H]([C@@H]2O)OC(=O)C)C[C@@H](C[C@@H]1O)C(=C)C3=O)C)(C)C)OC(=O)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon angustifolius var. glabrescens Ref.
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