input word = C00040005

Metabolite InformationStructural formula
Name Physalin J
Formula C28H30O10
Mw 526.18389718
CAS RN 57517-46-1
C_ID C00040005 ,
InChIKey VSLWNSSUMFSGFF-UGCCCVGNNA-N
InChICode InChI=1S/C28H30O10/c1-22-10-17-24(3)28-18(22)19(30)27(38-28,34-11-14(22)20(31)35-17)13-9-16-26(36-16)7-4-5-15(29)23(26,2)12(13)6-8-25(28,33)21(32)37-24/h4-5,12-14,16-18,33H,6-11H2,1-3H3/t12-,13+,14-,16-,17+,18-,22-,23-,24-,25-,26-,27+,28-/m0/s1
SMILES O1C(=O)[C@H]2[C@]3([C@H]4[C@]56[C@]([C@H]1C3)(OC(=O)[C@]5(CC[C@H]1[C@H]([C@@](C4=O)(OC2)O6)C[C@H]2[C@@]3([C@@]1(C(=O)C=CC3)C)O2)O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaePhysalis angulata Ref.
PlantaeSolanaceaePhysalis lancifolia Ref.
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