input word = C00030498

Metabolite InformationStructural formula
Name Hyodeoxycholic acid
alpha-Hyodeoxycholic acid
Formula C24H40O4
Mw 392.29265977
CAS RN 83-49-8
C_ID C00030498 ,
InChIKey DGABKXLVXPYZII-CIKRXNLKNA-N
InChICode InChI=1S/C24H40O4/c1-14(4-7-22(27)28)17-5-6-18-16-13-21(26)20-12-15(25)8-10-24(20,3)19(16)9-11-23(17,18)2/h14-21,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15-,16+,17-,18+,19+,20+,21+,23-,24-/m1/s1
SMILES C1[C@H](C[C@@H]2[C@](C1)([C@@H]1[C@@H](C[C@@H]2O)[C@H]2[C@](CC1)([C@H](CC2)[C@@H](CCC(=O)O)C)C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaBovidaeBos taurus domesticus GMELIN Ref.
--Sus scrofa domestica Ref.
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