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Substance Name: 5'-Dimethylaminobenzoxazinorifamycin
RN: 105396-14-3
InChIKey: UZCSWYKCOOXQJR-RSSAQDKHSA-N

Molecular Formula

  • C45-H53-N3-O12

Molecular Weight

  • 827.9227
 
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Names and Synonyms

  • 5'-Dimethylaminobenzoxazinorifamycin

Registry Numbers

CAS Registry Number

  • 105396-14-3

System Generated Number

  • 0105396143

Structure Descriptors

InChI

1S/C45H53N3O12/c1-20-13-12-14-21(2)44(55)47-35-39(53)32-31(34-42(35)59-30-19-27(48(9)10)15-16-28(30)46-34)33-41(25(6)38(32)52)60-45(8,43(33)54)57-18-17-29(56-11)22(3)40(58-26(7)49)24(5)37(51)23(4)36(20)50/h12-20,22-24,29,36-37,40,50-52H,1-11H3,(H,47,55)/b13-12+,18-17+,21-14-/t20-,22+,23+,24+,29-,36-,37+,40+,45-/m0/s1

InChIKey

UZCSWYKCOOXQJR-RSSAQDKHSA-N

Smiles

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(c2=O)c-5oc6cc(ccc6nc35)N(C)C)/C)C)O)C)O)C)OC(=O)C)C)OC)C)O