input word = C00023501

Metabolite InformationStructural formula
Name Amphiacrolide O
Formula C25H36O8
Mw 464.24101813
CAS RN 106793-94-6
C_ID C00023501 ,
InChIKey HXIWGPICAFPUEN-UGQSXZMTNA-N
InChICode InChI=1S/C25H36O8/c1-14-7-10-25(23(30)33-22-21(29)20(28)17(26)13-32-22)15(2)5-4-6-18(25)24(14,3)9-8-16-11-19(27)31-12-16/h5,11,14,17-18,20-22,26,28-29H,4,6-10,12-13H2,1-3H3/t14-,17-,18-,20-,21-,22-,24+,25+/m0/s1
SMILES CC1=CCC[C@@H]2[C@@]1(C(=O)O[C@@H]1OC[C@H](O)[C@H](O)C1O)CC[C@H](C)[C@@]2(C)CCC1=CC(=O)OC1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeGutierrezia texana Ref.
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