input word = C00042094

Metabolite InformationStructural formula
Name 2beta-Hydroxysalvigenolide
(-)-2beta-Hydroxysalvigenolide
Formula C22H22O8
Mw 414.13146768
CAS RN 855297-49-3
C_ID C00042094 ,
InChIKey DUJNCWIGAAEQEN-YUPLKDRMNA-N
InChICode InChI=1S/C22H22O8/c1-10-15-5-13(24)6-16-21(26)28-9-22(15,16)17(29-11(2)23)7-14-18(10)19(30-20(14)25)12-3-4-27-8-12/h3-4,6,8,13-15,17,19,24H,5,7,9H2,1-2H3/t13-,14+,15+,17+,19-,22-/m0/s1
SMILES CC(=O)O[C@@H]1C[C@H]2C(=O)O[C@@H](c3ccoc3)C2=C(C)[C@H]2C[C@H](O)C=C3C(=O)OCC321
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeSalvia xalapensis Ref.
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