input word = C00064514

Metabolite InformationStructural formula
Name (20R)-20-Acetoxy-4-pregnene-3,16-dione
Formula C23H32O4
Mw 372.23005951
CAS RN 7313-61-3
C_ID C00064514
InChIKey JIYCHSGWJICLGK-KUKJESENSA-N
InChICode InChI=1S/C23H32O4/c1-13(27-14(2)24)21-20(26)12-19-17-6-5-15-11-16(25)7-9-22(15,3)18(17)8-10-23(19,21)4/h11,13,17-19,21H,5-10,12H2,1-4H3/t13-,17-,18+,19+,21+,22+,23+/m1/s1
SMILES CC(=O)OC(C)C1C(=O)CC2C3CCC4=CC(=O)CCC4(C)C3CCC21C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBurseraceaeCommiphora mukul Ref.
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