input word = C00044357

Metabolite InformationStructural formula
Name Tonkinin B
(+)-Tonkinin B
Formula C37H66O7
Mw 622.48085446
CAS RN 182968-26-9
C_ID C00044357 ,
InChIKey ZGJBROCWEAASGS-ZTYYIGIVNA-N
InChICode InChI=1S/C37H66O7/c1-3-4-5-6-7-8-9-13-16-19-22-33(40)35-25-26-36(44-35)34(41)28-32(39)21-18-15-12-10-11-14-17-20-31(38)24-23-30-27-29(2)43-37(30)42/h27,29,32-36,39-41H,3-26,28H2,1-2H3/t29-,32-,33+,34+,35+,36+/m0/s1
SMILES O1[C@H](C=C(C1=O)CCC(=O)CCCCCCCCC[C@H](O)C[C@@H](O)[C@H]1CC[C@@H](O1)[C@@H](CCCCCCCCCCCC)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeUraria tonkinesis Ref.
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