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TOMATIDINE |
| Synonyms. Tomatidine; Tomatidin; (3beta,5alpha,22beta,25S)-Spirosolan-3-ol; 5alpha-Tomatidan-3beta-ol; (22S,25S)-5alpha-spirosolan-3beta-ol; 5alpha-Tomatidan-3beta-ol; |
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| PRODUCT IDENTIFICATION | |
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CAS RN |
77-59-8 (free base) |
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EINECS RN |
201-040-3 |
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FORMULA |
C27H45NO2 |
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MOLE WEIGHT |
415.65 |
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H.S CODE |
2938.90.0000 |
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SMILES |
C1[C@H](O)C[C@@H]2CC[C@@H]3[C@@H]([C@@]2(C1)C)CC[C@@ ]1([C @H] 3C [C@@H]2O[C@@]3([C@H]([C@H]12)C)CC[C@@H](CN3)C)C |
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CLASSIFICATION |
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EXTRA NOTES |
A 3β-hydroxy steroid resulting from the substitution of the 3β-hydrogen of tomatidane by a hydroxy group. ChEBI |
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| PHYSICAL AND CHEMICAL PROPERTIES | |
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PHYSICAL STATE. |
white to off-white crystalline powder |
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MELTING POINT |
202 ~ 210 C |
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BOILING POINT |
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DENSITY |
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SOLUBILITY IN WATER |
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| SOLVENT SOLUBILITY |
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VAPOR DENSITY |
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log P(octanol-water) |
6.92 |
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VAPOR PRESSURE |
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AUTOIGNITION TEMP |
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| pK |
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REFRACTIVE INDEX |
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FLASH POINT |
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| STABILITY AND REACTIVITY (HCl) | |
| STABILITY | Stable under normal conditions. |
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INCOMPATIBLE MATERIALS |
Strong acids, Strong bases |
| POLYMERIZATION |
Has not been reported |
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NFPA RATINGS |
Health: 0, Flammability: 0, Reactivity: 0 |
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| EXTERNAL LINKS & GENERAL DESCRIPTION |
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USA.gov - Tomatidine Google Scholar Search - Tomatidine U.S. National Library of Medicine - Tomatidine PubChem Compound Summary - Tomatidine KEGG (Kyoto Encyclopedia of Genes and Genomes) - Tomatidine ChEBI (http://www.ebi.ac.uk/chebi/) - Tomatidine NCBI (http://www.ncbi.nlm.nih.gov/) - Tomatidine Human Metabolome Database - Tomatidine Biochem/physiol Actions: Potent inhibitor of Staphylococcus aureus small-colony variants typically seen as complications of cystic fibrosis, with little or no effect on normal S. aureus strains. Also shows antiinflammatory activity by indirectly inhibiting iNOS and COX-2 pathways sigmaaldrich |
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| SALES SPECIFICATION (HCl) | |
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APPEARANCE |
white to off-white crystalline powder |
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ASSAY |
98% min |
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MELTING POINT |
265 ~ 270 C |
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OPTICAL ACTIVITY |
-4° ~ -6° (MeOH) |
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| TRANSPORT & REGULATORY INFORMATION | |
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UN NO. |
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| PACKING GROUP | |
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| SAFETY INFORMATION (HCl) | |
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HAZARD OVERVIEW |
GHS (Globally Harmonised System) Classification: Not a dangerous substance. |
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| PACKING |
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Preserve in light-resistant and well-closed containers |
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