input word = C00055652

Metabolite InformationStructural formula
Name 24-hydroxy beta-amyrin
Formula C30H50O2
Mw 442.38108084
CAS RN 119318-15-9
C_ID C00055652
InChIKey NTWLPZMPTFQYQI-FLZFTVBESA-N
InChICode InChI=1S/C30H50O2/c1-25(2)14-15-26(3)16-17-29(6)20(21(26)18-25)8-9-23-27(4)12-11-24(32)28(5,19-31)22(27)10-13-30(23,29)7/h8,21-24,31-32H,9-19H2,1-7H3/t21-,22+,23+,24-,26+,27-,28+,29+,30+/m0/s1
SMILES CC1(C)CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeMedicago truncatula Ref.
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OrganismMedicago truncatula
ReferenceGholami, A. et al., Nat. Prod. Rep., 31, (2014), 356-380.