input word = C00038302

Metabolite InformationStructural formula
Name 6beta-Hydroxytaraxasta-20-en-3-one
Formula C30H48O2
Mw 440.36543078
CAS RN 262359-58-0
C_ID C00038302 ,
InChIKey NHVBRVMNGMPCEO-HXWHBVIANA-N
InChICode InChI=1S/C30H48O2/c1-18-11-13-27(5)15-16-29(7)20(24(27)19(18)2)9-10-22-28(6)14-12-23(32)26(3,4)25(28)21(31)17-30(22,29)8/h11,19-22,24-25,31H,9-10,12-17H2,1-8H3/t19-,20-,21-,22-,24-,25+,27-,28-,29-,30-/m1/s1
SMILES CC1=CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5[C@H](O)C[C@]43C)[C@H]2[C@@H]1C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeChuquiraga ulicina ssp.ulicina Ref.
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