| CAS Number | 70253-62-2 |
| Catalog Number | AG00FDHL(AGN-PC-0TXVLU) |
| Chemical Name | Neospiramycin I |
| IUPAC Name | 2-[(4R,5S,6S,7R,9R,10R,11E,13E,16R)-6-[(2S,3R,4S,5S,6R)-4-(dimethylamino)-3,5-dihydroxy-6-methyloxan-2-yl]oxy-10-[(2S,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy-4-hydroxy-5-methoxy-9,16-dimethyl-2-oxo-1-oxacyclohexadeca-11,13-dien-7-yl]acetaldehyde |
| InChI | InChI=1S/C36H62N2O11/c1-21-19-25(17-18-39)34(49-36-33(43)31(38(7)8)32(42)24(4)47-36)35(44-9)27(40)20-29(41)45-22(2)13-11-10-12-14-28(21)48-30-16-15-26(37(5)6)23(3)46-30/h10-12,14,18,21-28,30-36,40,42-43H,13,15-17,19-20H2,1-9H3/b11-10+,14-12+/t21-,22-,23-,24-,25+,26+,27-,28+,30-,31+,32-,33-,34+,35+,36+/m1/s1 |
| InChI Key | SUBWVHAACKTENX-VZBUQJRSSA-N |
| MDL Number | MFCD03427445 |
| Molecular Formula | C36H62N2O11 |
| Molecular Weight | 698.8843 |
| SMILES | O([C@H]1[C@@H]([C@H]([C@@H]([C@@H](C)O1)O)N(C)C)O)[C@@H]1[C@H]([C@@H](CC(=O)O[C@H](C)CC=CC=C[C@@H]([C@H](C)C[C@@H]1CC=O)O[C@H]1CC[C@@H]([C@@H](C)O1)N(C)C)O)OC |
| Synonyms | neospiramycin I,
Neo Spiramycin I,
70253-62-2,
ZINC94313165,
Neospiramycin I,
NEOSPIRAMYCINI,
C36H62N2O11,
C36-H62-N2-O11,
|