input word = C00049158

Metabolite InformationStructural formula
Name Eriocalyxin C
(-)-Eriocalyxin C
Formula C22H28O7
Mw 404.18350325
CAS RN 84778-98-3
C_ID C00049158 ,
InChIKey LNLQGCZNVNCGKW-VJXMOMJTNA-N
InChICode InChI=1S/C22H28O7/c1-10(23)29-18-20-7-11(22(18)9-28-22)4-5-12(20)21-8-27-14(6-13(21)24)19(2,3)16(21)15(25)17(20)26/h11-12,14-16,18,25H,4-9H2,1-3H3/t11-,12-,14-,15+,16-,18+,20-,21-,22-/m1/s1
SMILES CC(=O)O[C@@H]1[C@@]2(CO2)[C@@H]2CC[C@H]3[C@]45CO[C@H](CC4=O)C(C)(C)[C@H]5[C@H](O)C(=O)[C@@]31C2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon eriocalyx Ref.
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