
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 4501-00-2 |
| Catalog No. | 2A-9030971 |
| Chinese Name | 磷酸红霉素 |
| Synonyms | Exact Mass 831.43800; PSA 281.48000; LogP 0.85700; InChIKey VUEMAFLGEMYXIH-YZPBMOCRSA-N; Synonyms |
| Molecular Formula | C37H70NO17P |
| Molecular Weight | 831.92200 |
| Purity | 98.00 |
| Boiling Point | 818.4ºC at 760mmHg |
| SMILES | CCC1OC(=O)C(C)C(OC2CC(C)(OC)C(O)C(C)O2)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)C(=O)C(C)C(O)C1(C)O.O=P(O)(O)O |
| InChI | InChI=1S/C37H67NO13.H3O4P/c1-14-25-37(10,45)30(41)20(4)27(39)18(2)16-35(8,44)32(51-34-28(40)24(38(11)12)15-19(3)47-34)21(5)29(22(6)33(43)49-25)50-26-17-36(9,46-13)31(42)23(7)48-26;1-5(2,3)4/h18-26,28-32,34,40-42,44-45H,14-17H2,1-13H3;(H3,1,2,3,4)/t18-,19-,20+,21+,22-,23+,24+,25-,26+,28-,29+,30-,31+,32-,34+,35-,36-,37-;/m1./s1 |
| InChI Key | VUEMAFLGEMYXIH-YZPBMOCRSA-N |
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