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Concept information

Preferred term

3 [(3 کولامیدوپروپیل) دی متیل آمونیو] پروپان 1 سولفونات  

Type

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

charge

  • 0

formula

  • C32H58N2O7S

has_functional_parent

inchi

  • InChI=1S/C32H58N2O7S/c1-21(8-11-29(38)33-14-6-15-34(4,5)16-7-17-42(39,40)41)24-9-10-25-30-26(20-28(37)32(24,25)3)31(2)13-12-23(35)18-22(31)19-27(30)36/h21-28,30,35-37H,6-20H2,1-5H3,(H-,33,38,39,40,41)/t21-,22+,23-,24-,25+,26+,27-,28+,30+,31+,32-/m1/s1

inchikey

  • UMCMPZBLKLEWAF-BCTGSCMUSA-N

mass

  • 614.879

monoisotopicmass

  • 614.39647

smiles

  • C[C@H](CCC(=O)NCCC[N+](C)(C)CCCS([O-])(=O)=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:1418

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