input word = C00040979

Metabolite InformationStructural formula
Name Glabcensin P
(-)-Glabcensin P
Formula C27H40O10
Mw 524.2621475
CAS RN 196607-61-1
C_ID C00040979 ,
InChIKey QIUOIEYFOUUJFV-RQOYUBBUNA-N
InChICode InChI=1S/C27H40O10/c1-12(28)35-18-8-15-9-27(22(32)16(15)11-34-7)20(18)26(6)10-17(31)24(37-14(3)30)25(4,5)21(26)19(23(27)33)36-13(2)29/h15-21,23-24,31,33H,8-11H2,1-7H3/t15-,16-,17+,18+,19-,20+,21-,23+,24+,26+,27+/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)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon angustifolius var. glabrescens Ref.
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OrganismIsodon angustifolius var. glabrescens
ReferenceZhao,Phytochem.,50,(1999),123