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Concept information

Preferred term

(2R,3R,5S,6R) 6 (اتیل) 2 (S pantetheinyl) carbapenam 3 carboxylate  

Type

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

charge

  • -1

formula

  • C20H32N3O7S

inchi

  • InChI=1S/C20H33N3O7S/c1-4-11-12-9-13(15(19(29)30)23(12)18(11)28)31-8-7-21-14(25)5-6-22-17(27)16(26)20(2,3)10-24/h11-13,15-16,24,26H,4-10H2,1-3H3,(H,21,25)(H,22,27)(H,29,30)/p-1/t11-,12+,13-,15+,16+/m1/s1

inchikey

  • VBDJIAPAESIRHW-WALBABNVSA-M

mass

  • 458.550

monoisotopicmass

  • 458.19665

smiles

  • N12[C@]([C@@](CC)(C1=O)[H])(C[C@H]([C@H]2C(=O)[O-])SCCNC(CCNC(=O)[C@@H](C(CO)(C)C)O)=O)[H]

subset

  • 2_STAR

synonym EXACT

  • (2R,3R,5S,6R)-6-(ethyl)-2-(S-pantetheinyl)-carbapenam-3-carboxylate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:230522

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