| CAS Number | 464-74-4 |
| Catalog Number | AG00DB84(AGN-PC-0RUF7B) |
| Chemical Name | Arenobufagin |
| IUPAC Name | 5-[(3S,5R,8R,9S,10S,11S,13R,14S,17R)-3,11,14-trihydroxy-10,13-dimethyl-12-oxo-2,3,4,5,6,7,8,9,11,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pyran-2-one |
| InChI | InChI=1S/C24H32O6/c1-22-9-7-15(25)11-14(22)4-5-17-19(22)20(27)21(28)23(2)16(8-10-24(17,23)29)13-3-6-18(26)30-12-13/h3,6,12,14-17,19-20,25,27,29H,4-5,7-11H2,1-2H3/t14-,15+,16-,17-,19-,20+,22+,23+,24+/m1/s1 |
| InChI Key | JGDCRWYOMWSTFC-AZGSIFHYSA-N |
| MDL Number | MFCD01740820 |
| Molecular Formula | C24H32O6 |
| Molecular Weight | 416.5073 |
| SMILES | C[C@]([C@@H](C(C=C1)=COC1=O)CC2)(C3=O)[C@]2([C@@](CC[C@@]4([H])[C@@]5(CC[C@H](O)C4)C)([H])[C@]5([H])[C@@H]3O)O |
| Synonyms | 3,11,14-trihydroxy-12-oxo-bufa-20,22-dienolide,
arenobufagin,
Arenobufagin,
464-74-4,
12-Oxo-3-beta,11-alpha,14-trihydroxy-5-beta-bufa-20,22-dienolide,
5-beta-BUFA-20,22-DIENOLIDE, 12-OXO-3-beta,11-alpha,14-TRIHYDROXY-,
CHEMBL4086974,
Bufa-20,22-dienolide, 3,11,14-trihydroxy-12-oxo- (3-beta,5-beta,11-alpha)-,
HY-N0876,
MFCD01740820,
ZINC33832850,
AKOS030526814,
CS-3693,
NCGC00485924-01,
C20035,
ACN-047479,
C24-H32-O6,
|