Molecular Structure:
CCD No.:CCD00044452
SMILAGENIN ACETATE
CAS No.:
4947-75-5
Formula:C29 H46 O4
MolWeight:458.678
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| Product Name： | SMILAGENIN ACETATE |
| CAS： | 4947-75-5 |
| English Synonyms： | 5BETA,20ALPHA,22ALPHA,25D-SPIROSTAN-3BETA-OL ACETATE ; SMILAGENIN ACETATE ; 25R,5BETA-SPIROSTAN-3BETA-OL 3-ACETATE |
| MDL Number.： | MFCD00067286 |
| H bond acceptor： | 4 |
| H bond donor： | 0 |
| Smile： | C[C@@H]1CC[C@@]2([C@H]([C@H]3[C@@H](O2)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC[C@H]6[C@@]5(CC[C@@H](C6)OC(=O)C)C)C)C)OC1 |
| InChi： | InChI=1S/C29H46O4/c1-17-8-13-29(31-16-17)18(2)26-25(33-29)15-24-22-7-6-20-14-21(32-19(3)30)9-11-27(20,4)23(22)10-12-28(24,26)5/h17-18,20-26H,6-16H2,1-5H3/t17-,18+,20-,21+,22-,23+,24+,25+,26+,27+,28+,29-/m1/s1 |
| InChiKey： | InChIKey=LVRAKYNQYKVPIK-BSPYNPCNSA-N |
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Basic Information
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