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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > ion > anion > polyatomic anion > oxoanion > carboxylic acid anion > monocarboxylic acid anion > (2r,3r,5s)-2-(s-pantetheinyl)-carbapenam-3-carboxylate
... > chemical entity > molecular entity > ion > polyatomic ion > polyatomic anion > oxoanion > carboxylic acid anion > monocarboxylic acid anion > (2r,3r,5s)-2-(s-pantetheinyl)-carbapenam-3-carboxylate
... > chemical entity > molecular entity > polyatomic entity > polyatomic ion > polyatomic anion > oxoanion > carboxylic acid anion > monocarboxylic acid anion > (2r,3r,5s)-2-(s-pantetheinyl)-carbapenam-3-carboxylate
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxide > oxoanion > carboxylic acid anion > monocarboxylic acid anion > (2r,3r,5s)-2-(s-pantetheinyl)-carbapenam-3-carboxylate
... > chemical entity > molecular entity > ion > anion > organic anion > carboxylic acid anion > monocarboxylic acid anion > (2r,3r,5s)-2-(s-pantetheinyl)-carbapenam-3-carboxylate
... > chemical entity > molecular entity > ion > organic ion > organic anion > carboxylic acid anion > monocarboxylic acid anion > (2r,3r,5s)-2-(s-pantetheinyl)-carbapenam-3-carboxylate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic ion > organic anion > carboxylic acid anion > monocarboxylic acid anion > (2r,3r,5s)-2-(s-pantetheinyl)-carbapenam-3-carboxylate

Preferred term

(2r,3r,5s)-2-(s-pantetheinyl)-carbapenam-3-carboxylate  

Type

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

Broader concept

charge

  • -1

formula

  • C18H28N3O7S

inchi

  • InChI=1S/C18H29N3O7S/c1-18(2,9-22)15(25)16(26)20-4-3-12(23)19-5-6-29-11-7-10-8-13(24)21(10)14(11)17(27)28/h10-11,14-15,22,25H,3-9H2,1-2H3,(H,19,23)(H,20,26)(H,27,28)/p-1/t10-,11+,14-,15-/m0/s1

inchikey

  • XJMYKDFZQNYDFC-JLUCKKNBSA-M

mass

  • 430.500

monoisotopicmass

  • 430.16535

smiles

  • N12[C@](CC1=O)(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)-2-(S-pantetheinyl)-carbapenam-3-carboxylate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:230520

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