Pro_Molecular_Structure:
pro_cas:
218600-44-3
Product_Name.:
pro_cdbregno:CCD00601687
pro_formula:C31 H41 N O4
pro_molWeight:491.668
* If the product has intellectual property rights, a license granted is must or contact us.
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| Product_Name： | BARDOXOLONE |
| CAS： | 218600-44-3 |
| EnglishSynonyms： | 2-CYANO-3,12-DIOXOOLEANA-1,9-DIEN-28-OIC ACID ; OLEANA-1,9(11)-DIEN-28-OIC ACID, 2-CYANO-3,12-DIOXO- ; (4AS,6AR,6BS,8AR,12AS,14AR,14BS)-11-CYANO-2,2,6A,6B,9,9,12A-HEPTAMETHYL-10,14-DIOXO-1,2,3,4,4A,5,6,6A,6B,7,8,8A,9,10,12A,14,14A,14B-OCTADECAHYDROPICENE-4A-CARBOXYLIC ACID ; BARDOXOLONE ; CDDO ; 2-CYANO-3,12-DIOXOOLEANE-1,9(11)-DIEN-28-OIC ACID ; RTA 401 |
| pro_mdlNumber： | MFCD07772296 |
| pro_acceptors： | 5 |
| pro_donors： | 1 |
| pro_smile： | CC1(CC[C@@]2(CC[C@@]3([C@@H]([C@@H]2C1)C(=O)C=C4[C@]3(CC[C@@H]5[C@@]4(C=C(C(=O)C5(C)C)C#N)C)C)C)C(=O)O)C |
| InChi： | InChI=1S/C31H41NO4/c1-26(2)10-12-31(25(35)36)13-11-30(7)23(19(31)16-26)20(33)14-22-28(5)15-18(17-32)24(34)27(3,4)21(28)8-9-29(22,30)6/h14-15,19,21,23H,8-13,16H2,1-7H3,(H,35,36)/t19-,21-,23-,28-,29+,30+,31-/m0/s1 |
| InChiKey： | InChIKey=TXGZJQLMVSIZEI-UQMAOPSPSA-N |
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basic_info
* If the product has intellectual property rights, a license granted is must or contact us.
