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Contact us: CRM@email.irandoc.ac.ir

Concept information

Preferred term

remogliflozin etabonate  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C26H38N2O9

inchi

  • InChI=1S/C26H38N2O9/c1-7-33-26(32)34-13-20-21(29)22(30)23(31)25(36-20)37-24-19(16(6)28(27-24)14(2)3)12-17-8-10-18(11-9-17)35-15(4)5/h8-11,14-15,20-23,25,29-31H,7,12-13H2,1-6H3/t20-,21-,22+,23-,25+/m1/s1

inchikey

  • UAOCLDQAQNNEAX-ABMICEGHSA-N

mass

  • 522.595

monoisotopicmass

  • 522.25773

smiles

  • O1[C@@H]([C@@H](O)[C@H](O)[C@@H](O)[C@@H]1OC2=NN(C(=C2CC3=CC=C(OC(C)C)C=C3)C)C(C)C)COC(OCC)=O

subset

  • 2_STAR

synonym EXACT

  • ethyl [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[5-methyl-1-propan-2-yl-4-[(4-propan-2-yloxyphenyl)methyl]pyrazol-3-yl]oxyoxan-2-yl]methyl carbonate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:177541

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