TILMICOSIN PHOSPHATE ,137330-13-3 _Chemical Cloud Database

TILMICOSIN PHOSPHATE

Basic Information
Product Name：	TILMICOSIN PHOSPHATE
CAS：	137330-13-3
English Synonyms：	TILMICOSIN PHOSPHATE ; [(2R,3R,4E,6E,9R,11R,12S,13S,14R)-12-[[3,6-DIDEOXY-3-(DIMETHYLAMINO)-BETA-D-GLUCOPYRANOSYL]OXY]-11-[2-[(3R,5S)-3,5-DIMETHYL-1-PIPERIDINYL]ETHYL)-2-ETHYL-14-HYDROXY-5,9,13-TRIMETHYL-8,16-DIOXOOXACYCLOHEXADECA-4,6-DIEN-3-YL]METHYL 6-DEOXY-2,3-DI-O-METHYL-BETA-D-ALLOPYRANOSIDE PHOSPHATE (1:1) ; 20-DEOXO-20-(3,5-DIMETHYL-1-PIPERIDINYL)DESMYCOSIN PHOSPHATE
MDL Number.：	MFCD06797805
H bond acceptor：	15
H bond donor：	4
Smile：	CC[C@@H]1[C@H](/C=C(/C=C/C(=O)[C@@H](C[C@@H]([C@@H]([C@H]([C@@H](CC(=O)O1)O)C)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C)O)N(C)C)O)CCN3C[C@H](C[C@H](C3)C)C)C)\C)CO[C@H]4[C@@H]([C@@H]([C@@H]([C@H](O4)C)O)OC)OC.OP(=O)(O)O
InChi：	InChI=1S/C46H80N2O13.H3O4P/c1-13-36-33(24-57-46-44(56-12)43(55-11)40(53)31(8)59-46)19-25(2)14-15-34(49)28(5)20-32(16-17-48-22-26(3)18-27(4)23-48)42(29(6)35(50)21-37(51)60-36)61-45-41(54)38(47(9)10)39(52)30(7)58-45;1-5(2,3)4/h14-15,19,26-33,35-36,38-46,50,52-54H,13,16-18,20-24H2,1-12H3;(H3,1,2,3,4)/b15-14+,25-19+;/t26-,27+,28-,29+,30-,31-,32+,33-,35-,36-,38+,39-,40-,41-,42-,43-,44-,45+,46-;/m1./s1
InChiKey：	InChIKey=NESIVXZOSKKUDP-ARVJLQODSA-N
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