7Beta-Hydroxybufalin

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Catalog Number ACM20143979
Product Name 7Beta-Hydroxybufalin
CAS Number 20143-97-9
IUPAC Name 5-[(3S,5S,7S,8S,9S,10S,13R,14S,17R)-3,7,14-trihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pyran-2-one
Molecular Weight 402.53
Molecular Formula C24H34O5
Canonical SMILES CC12CCC(CC1CC(C3C2CCC4(C3(CCC4C5=COC(=O)C=C5)O)C)O)O
Inchi InChI=1S/C24H34O5/c1-22-8-5-16(25)11-15(22)12-19(26)21-18(22)6-9-23(2)17(7-10-24(21,23)28)14-3-4-20(27)29-13-14/h3-4,13,15-19,21,25-26,28H,5-12H2,1-2H3/t15-,16-,17+,18-,19-,21-,22-,23+,24-/m0/s1
InChIKey IZQUQFWHNJERCJ-XKPFVIKISA-N
Purity 98%
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