Molecular Structure:
CCD No.:CCD00136373
PREDNIVAL
CAS No.:
15180-00-4
Formula:C26 H36 O6
MolWeight:444.564
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| Product Name： | PREDNIVAL |
| CAS： | 15180-00-4 |
| English Synonyms： | PREDNIVAL ; PREDNISOLONE 17-VALERATE ; 1,4-PREGNADIEN-11BETA,17,21-TRIOL-3,20-DIONE 17-VALERATE |
| MDL Number.： | MFCD00468097 |
| H bond acceptor： | 6 |
| H bond donor： | 2 |
| Smile： | CCCCC(=O)O[C@@]1(CC[C@@H]2[C@@]1(C[C@@H]([C@H]3[C@H]2CCC4=CC(=O)C=C[C@]34C)O)C)C(=O)CO |
| InChi： | InChI=1S/C26H36O6/c1-4-5-6-22(31)32-26(21(30)15-27)12-10-19-18-8-7-16-13-17(28)9-11-24(16,2)23(18)20(29)14-25(19,26)3/h9,11,13,18-20,23,27,29H,4-8,10,12,14-15H2,1-3H3/t18-,19-,20-,23+,24-,25-,26-/m0/s1 |
| InChiKey： | InChIKey=BOFKYYWJAOZDPB-FZNHGJLXSA-N |
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