input word = C00048527

Metabolite InformationStructural formula
Name Rubescensin Q
(-)-Rubescensin Q
Formula C22H32O6
Mw 392.21988875
CAS RN 851868-64-9
C_ID C00048527 ,
InChIKey MYVKBFBIDRWUTH-LGMRVMHLNA-N
InChICode InChI=1S/C22H32O6/c1-11-13-6-7-14-20-9-5-8-19(3,4)15(20)18(28-12(2)23)22(26,27-10-20)21(14,16(11)24)17(13)25/h13-18,24-26H,1,5-10H2,2-4H3/t13-,14-,15+,16+,17+,18-,20?,21+,22?/m0/s1
SMILES C1[C@]23[C@@H](C(CC1)(C)C)[C@@H]([C@]([C@]14[C@H]2CC[C@@H](C(=C)[C@H]1O)[C@H]4O)(OC3)O)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon sinuolata Ref.
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