![(S)-1-((3S,8R,9S,10R,13R,14S,17S)-13-(HYDROXYMETHYL)-10-METHYL-3-(METHYLAMINO)-2,3,4,7,8,9,10,11,12,13,14,15,16,17-TETRADECAHYDRO-1H-CYCLOPENTA[A]PHENANTHREN-17-YL)ETHANOL structure, CAS 17083-11-3](/structures/120000/100585_3_17083_11_3.png)
CAS Number17083-11-3
Synonyms(20S)-Des-A,B-22-(acetoxy)-23,24-dinorcholane-8-one; 3,5-dimethoxy-N-((5-thioxo-4-(m-tolyl)-4,5-dihydro-1H-1,2,4-triazol-3-yl)methyl)benzamide
Molecular FormulaC22H37NO2
Molecular Weight347.53500
Purity96+%
Density1.1g/cm3
Boiling Point485.2ºC at 760mmHg
EINECS0
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 17083-11-3 |
| Catalog No. | 2A-0100585 |
| Chinese Name | Paravallarinol |
| Synonyms | (20S)-Des-A,B-22-(acetoxy)-23,24-dinorcholane-8-one; 3,5-dimethoxy-N-((5-thioxo-4-(m-tolyl)-4,5-dihydro-1H-1,2,4-triazol-3-yl)methyl)benzamide |
| Molecular Formula | C22H37NO2 |
| Molecular Weight | 347.53500 |
| Purity | 96+ |
| Density | 1.1g/cm3 |
| Boiling Point | 485.2ºC at 760mmHg |
| EINECS | 0 |
| HTC | 0 |
| UN(IATA) | 0 |
| SMILES | CNC1CCC2(C)C(=CCC3C2CCC2(CO)C(C(C)O)CCC32)C1 |
| InChI | InChI=1S/C22H37NO2/c1-14(25)18-6-7-20-17-5-4-15-12-16(23-3)8-10-21(15,2)19(17)9-11-22(18,20)13-24/h4,14,16-20,23-25H,5-13H2,1-3H3/t14-,16-,17+,18+,19-,20-,21-,22-/m0/s1 |
| InChI Key | JASSGIGGJMGBFO-QLPKIABKSA-N |
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