| Name： | (2-METHYL-N-BUTYRYL)SHIKONIN |
| CAS： | 52387-15-2 ;92175-42-3 |
| Synonyms： | 5,8-DIHYDROXY-2-[1-(2-METHYLBUTYRYLOXY)-4-METHYL-3-PENTENYL]-1,4-NAPHTHALENEDIONE ; ALPHA-METHYL-N-BUTYRYLSHIKONIN ; (2-METHYL-N-BUTYRYL)SHIKONIN ; (2-METHYLBUTYRYL)SHIKONIN |
| MDL.： | MFCD00142946 |
| H bond acceptor： | 6 |
| H bond donor： | 2 |
| Smile： | CCC(C)C(=O)O[C@H](CC=C(C)C)C1=CC(=O)c2c(ccc(c2C1=O)O)O |
| InChi： | InChI=1S/C21H24O6/c1-5-12(4)21(26)27-17(9-6-11(2)3)13-10-16(24)18-14(22)7-8-15(23)19(18)20(13)25/h6-8,10,12,17,22-23H,5,9H2,1-4H3/t12?,17-/m1/s1 |
| InChiKey： | InChIKey=ODQATBANLZCROD-RGUGMKFQSA-N |
Property |
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| Comments： | ASSAY (HPLC) |
| Specification： | GUARANTEED REAGENT |
Safety information |
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(2-METHYL-N-BUTYRYL)SHIKONIN
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