input word = C00040661

Metabolite InformationStructural formula
Name Withaphysanolide
Formula C28H38O7
Mw 486.26175357
CAS RN 74799-65-8
C_ID C00040661 ,
InChIKey HEDJQUGJAAFDJP-UHFFFAOYNA-N
InChICode InChI=1S/C28H38O7/c1-15-14-22(35-23(31)16(15)2)26(5,32)28(34)13-10-18-17-8-12-27(33)21(30)7-6-20(29)25(27,4)19(17)9-11-24(18,28)3/h6-7,19,21-22,30,32-34H,8-14H2,1-5H3/t19-,21-,22-,24-,25-,26-,27-,28+/m0/s1
SMILES C1=C[C@@H]([C@@]2([C@](C1=O)([C@@H]1C(=C3[C@](CC1)([C@@](CC3)(O)[C@@]([C@@H]1CC(=C(C(=O)O1)C)C)(C)O)C)CC2)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaePhysalis angulata Ref.
PlantaeSolanaceaePhysalis peruviana Ref.
PlantaeSolanaceaePhysalis pruinosa Ref.
zoom in



OrganismPhysalis pruinosa
ReferenceSakurai, K. et al., Chem. Pharm. Bull., 1976, 24, 1403-1405 (4-Hydroxywithanolide E)