29-(2-Admantyl)methyleremomycin aglycone hexapeptide structure
|
Common Name | 29-(2-Admantyl)methyleremomycin aglycone hexapeptide | ||
|---|---|---|---|---|
| CAS Number | 562105-25-3 | Molecular Weight | 1145.559 | |
| Density | 1.5±0.1 g/cm3 | Boiling Point | N/A | |
| Molecular Formula | C57H57ClN8O16 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
| Name | 29-(2-Admantyl)methyleremomycin aglycone hexapeptide |
|---|---|
| Synonym | More Synonyms |
| Density | 1.5±0.1 g/cm3 |
|---|---|
| Molecular Formula | C57H57ClN8O16 |
| Molecular Weight | 1145.559 |
| Exact Mass | 1144.358154 |
| LogP | 1.34 |
| Index of Refraction | 1.661 |
| InChIKey | VADYNDIXZGALFR-ORAWRPTHSA-N |
| SMILES | NC(=O)CC1NC(=O)C(N)C(O)c2ccc(c(Cl)c2)Oc2cc3cc(c2O)Oc2ccc(cc2)C(O)C2NC(=O)C(NC(=O)C3NC1=O)c1ccc(O)c(c1)-c1c(cc(O)c(CC3C4CC5CC(C4)CC3C5)c1O)C(C(=O)O)NC2=O |
| (1S,2R,18R,19R,22S,25R,28R,40S)-36-[(Adamantan-2-ylmethyl)amino]-19-amino-22-(2-amino-2-oxoethyl)-15-chloro-2,18,32,35,37,48-hexahydroxy-20,23,26,42,44-pentaoxo-7,13-dioxa-21,24,27,41,43-pentaazaoctac ;yclo[26.14.2.23,6.214,17.18,12.129,33.010,25.034,39]pentaconta-3,5,8(48),9,11,14,16,29(45),30,32,34,36,38,46,49-pentadecaene-40-carboxylic acid |