Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Rifamycin, 3-((1-pyrrolidinylmethyl)thio)-
RN: 13724-92-0
InChIKey: BLDRBWAFMLTIOA-WHPTZXDASA-N

Molecular Formula

  • C42-H56-N2-O12-S

Molecular Weight

  • 812.9724
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • 3-Thioether of rifamycin SV

Systematic Name

  • Rifamycin, 3-((1-pyrrolidinylmethyl)thio)-

Registry Numbers

CAS Registry Number

  • 13724-92-0

System Generated Number

  • 0013724920

Structure Descriptors

InChI

1S/C42H56N2O12S/c1-20-13-12-14-21(2)41(52)43-31-35(49)29-28(36(50)39(31)57-19-44-16-10-11-17-44)30-38(25(6)34(29)48)56-42(8,40(30)51)54-18-15-27(53-9)22(3)37(55-26(7)45)24(5)33(47)23(4)32(20)46/h12-15,18,20,22-24,27,32-33,37,46-50H,10-11,16-17,19H2,1-9H3,(H,43,52)/b13-12+,18-15+,21-14-/t20-,22+,23+,24+,27-,32-,33+,37+,42-/m0/s1

InChIKey

BLDRBWAFMLTIOA-WHPTZXDASA-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(c2O)c(c3O)SCN5CCCC5)/C)C)O)C)O)C)OC(=O)C)C)OC)C)O