input word = C00048253

Metabolite InformationStructural formula
Name 15-Hydroxyponasterone A
(+)-15-Hydroxyponasterone A
Formula C27H44O7
Mw 480.30870376
CAS RN 1026800-42-9
C_ID C00048253 ,
InChIKey DJGJBKOKVVFGFR-ARFBDGGKNA-N
InChICode InChI=1S/C27H44O7/c1-14(2)6-7-22(31)26(5,33)21-12-23(32)27(34)16-10-18(28)17-11-19(29)20(30)13-24(17,3)15(16)8-9-25(21,27)4/h10,14-15,17,19-23,29-34H,6-9,11-13H2,1-5H3/t15-,17-,19+,20-,21-,22+,23+,24+,25+,26+,27-/m0/s1
SMILES CC(C)CC[C@@H](O)[C@](C)(O)[C@H]1C[C@@H](O)[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeRhaponticum carthamoides Ref.
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OrganismRhaponticum carthamoides
ReferenceKokoska,Phytochem.,70,(2009),842