RIFANDIN ,57184-22-2 _Chemical Cloud Database

RIFANDIN

Basic Information
Product Name：	RIFANDIN
CAS：	57184-22-2 ;89499-17-2
English Synonyms：	RIFAMYCIN, 3-[4-(2-METHYLPROPYL)-1-PIPERAZINYL]- ; RIFANDIN ; 3-(4-(2-METHYLPROPYL)-1-PIPERAZINYL)-RIFAMYCIN ; RIFANDINE ; R 761
MDL Number.：	MFCD01684625
H bond acceptor：	15
H bond donor：	6
Smile：	Cc1c(c2c3c4c1O[C@@](C4=O)(O/C=C/[C@@H]([C@H]([C@H]([C@@H]([C@@H]([C@@H]([C@H]([C@H](/C=C/C=C(\C(=O)Nc(c2O)c(c3O)N5CCN(CC5)CC(C)C)/C)C)O)C)O)C)OC(=O)C)C)OC)C)O
InChi：	InChI=1S/C45H63N3O12/c1-22(2)21-47-16-18-48(19-17-47)35-34-39(53)32-31(40(35)54)33-42(28(8)38(32)52)60-45(10,43(33)55)58-20-15-30(57-11)25(5)41(59-29(9)49)27(7)37(51)26(6)36(50)23(3)13-12-14-24(4)44(56)46-34/h12-15,20,22-23,25-27,30,36-37,41,50-54H,16-19,21H2,1-11H3,(H,46,56)/b13-12+,20-15+,24-14-/t23-,25+,26+,27+,30-,36-,37+,41+,45-/m0/s1
InChiKey：	InChIKey=XUBKCCSAVNRWOX-BVHPQESASA-N

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