input word = C00040968

Metabolite InformationStructural formula
Name Glabcensin E
(-)-Glabcensin E
Formula C26H36O9
Mw 492.23593275
CAS RN 196607-49-5
C_ID C00040968 ,
InChIKey OTGJHZVYFNKBOP-NGGMCDFYNA-N
InChICode InChI=1S/C26H36O9/c1-11-15-8-16(30)19-25(7)10-17(31)22(34-13(3)28)24(5,6)20(25)18(33-12(2)27)23(35-14(4)29)26(19,9-15)21(11)32/h15-20,22-23,30-31H,1,8-10H2,2-7H3/t15-,16+,17+,18-,19+,20-,22+,23+,25-,26+/m1/s1
SMILES C=C1C(=O)[C@]23C[C@H]1C[C@H](O)[C@H]2[C@]1(C)C[C@H](O)[C@H](OC(C)=O)C(C)(C)[C@H]1[C@@H](OC(C)=O)[C@@H]3OC(C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon angustifolius var. glabrescens Ref.
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