input word = C00023383

Metabolite InformationStructural formula
Name Sterebin B
Formula C20H32O5
Mw 352.22497413
CAS RN 107668-80-4
C_ID C00023383 ,
InChIKey BNOWPELKBYSHKU-OQYWXRDBNA-N
InChICode InChI=1S/C20H32O5/c1-12(21)8-9-14-19(5)11-7-10-18(3,4)16(19)15(25-13(2)22)17(23)20(14,6)24/h8-9,14-17,23-24H,7,10-11H2,1-6H3/b9-8+/t14-,15-,16+,17+,19-,20+/m1/s1
SMILES CC(=O)/C=C/[C@H]1[C@](C)(O)[C@@H](O)[C@H](OC(C)=O)C2C(C)(C)CCC[C@@]21C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeStevia rebaudiana Ref.
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