Basic Information |
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Product Name: | TOMATIDINE HYDROCHLORIDE |
CAS: | 6192-62-7 |
English Synonyms: | TOMATIDIN HYDROCHLORIDE ; TOMATIDINE HCL ; (3BETA,5ALPHA,22BETA,25S)-SPIROSOLAN-3-OL HYDROCHLORIDE ; SPIRPSOLAN-3-OL-(3B,5A,22B,25C) HCL ; TOMATIDINE HYDROCHLORIDE ; 3BETA-HYDROXY-5ALPHA-TOMATIDANE HYDROCHLORIDE ; 5ALPHA-TOMATIDAN-3BETA-OL HYDROCHLORIDE |
MDL Number.: | MFCD00133866 |
H bond acceptor: | 3 |
H bond donor: | 2 |
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)O)C)C)C)NC1.Cl |
InChi: | InChI=1S/C27H45NO2.ClH/c1-16-7-12-27(28-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(29)8-10-25(18,3)21(20)9-11-26(22,24)4;/h16-24,28-29H,5-15H2,1-4H3;1H/t16-,17-,18-,19-,20+,21-,22-,23-,24-,25-,26-,27+;/m0./s1 |
InChiKey: | InChIKey=SXXHVPYRDFJKPG-XRWUXUKGSA-N |
Property |
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Comments: | CRYSTALLINE |
Safety information |
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WGK Germany: | 3 |
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