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Concept information

Preferred term

هیدروکلراید بوپرنورفین  

Type

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

Broader concept

alt_id

  • CHEBI:3217
  • CHEBI:396026

charge

  • 0

formula

  • C29H42ClNO4

has_role

inchi

  • InChI=1S/C29H41NO4.ClH/c1-25(2,3)26(4,32)20-15-27-10-11-29(20,33-5)24-28(27)12-13-30(16-17-6-7-17)21(27)14-18-8-9-19(31)23(34-24)22(18)28;/h8-9,17,20-21,24,31-32H,6-7,10-16H2,1-5H3;1H/t20-,21-,24-,26+,27-,28+,29-;/m1./s1

inchikey

  • UAIXRPCCYXNJMQ-RZIPZOSSSA-N

mass

  • 504.10100

monoisotopicmass

  • 503.28024

smiles

  • [Cl-].[H][C@@]1(C[C@]23CC[C@]1(OC)[C@@H]1Oc4c(O)ccc5C[C@H]2[NH+](CC[C@@]31c45)CC1CC1)[C@](C)(O)C(C)(C)C

subset

  • 3_STAR

synonym EXACT

  • (5alpha,6beta,14beta,18R)-17-(cyclopropylmethyl)-18-[(2S)-2-hydroxy-3,3-dimethylbutan-2-yl]-6-methoxy-18,19-dihydro-4,5-epoxy-6,14-ethenomorphinan-3-ol hydrochloride

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:652822

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