input word = C00023523

Metabolite InformationStructural formula
Name Teupyrin B
Formula C22H32O7
Mw 408.21480338
CAS RN 103827-25-4
C_ID C00023523 ,
InChIKey XDFUGHPIAIPFJC-DDLIMUGXNA-N
InChICode InChI=1S/C22H32O7/c1-13-8-19(29-14(2)24)21(11-23)17(4-5-18(26)22(21)12-28-22)20(13,3)9-16(25)15-6-7-27-10-15/h6-7,10,13,16-19,23,25-26H,4-5,8-9,11-12H2,1-3H3/t13-,16-,17-,18+,19+,20+,21+,22-/m1/s1
SMILES C1[C@@H]([C@]2([C@]3([C@H](C1)[C@]([C@@H](C[C@@H]3OC(=O)C)C)(C[C@H](c1cocc1)O)C)CO)OC2)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeTeucrium pyrenaicum Ref.
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