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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > monocarboxylic acid amide > amidobenzoic acid > antimycin a13
organooxygen compound > carboxamide > monocarboxylic acid amide > amidobenzoic acid > antimycin a13
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > monocarboxylic acid amide > amidobenzoic acid > antimycin a13
... > organooxygen compound > carbonyl compound > carboxylic acid > aromatic carboxylic acid > benzoic acids > amidobenzoic acid > antimycin a13
... > organooxygen compound > carbon oxoacid > carboxylic acid > aromatic carboxylic acid > benzoic acids > amidobenzoic acid > antimycin a13
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > aromatic carboxylic acid > benzoic acids > amidobenzoic acid > antimycin a13
... > chemical entity > molecular entity > main group molecular entity > s-block molecular entity > hydrogen molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > aromatic carboxylic acid > benzoic acids > amidobenzoic acid > antimycin a13
organic aromatic compound > aromatic carboxylic acid > benzoic acids > amidobenzoic acid > antimycin a13

Preferred term

antimycin a13  

Type

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

Broader concept

charge

  • 0

formula

  • C28H40N2O9

inchi

  • InChI=1S/C28H40N2O9/c1-6-8-10-20-25(39-22(32)14-13-16(3)7-2)18(5)38-28(36)23(17(4)37-27(20)35)30-26(34)19-11-9-12-21(24(19)33)29-15-31/h9,11-12,15-18,20,23,25,33H,6-8,10,13-14H2,1-5H3,(H,29,31)(H,30,34)/t16?,17-,18+,20-,23+,25+/m1/s1

inchikey

  • DBRQOXPBANMULX-WJYIPEHTSA-N

mass

  • 548.633

monoisotopicmass

  • 548.27338

smiles

  • O=C1O[C@H]([C@H](OC(=O)CCC(CC)C)[C@@H](CCCC)C(O[C@@H]([C@@H]1NC(=O)C2=C(O)C(NC=O)=CC=C2)C)=O)C

subset

  • 2_STAR

synonym EXACT

  • [(2R,3S,6S,7R,8R)-8-butyl-3-[(3-ormamido-2-hydroxybenzoyl)amino]-2,6-dimethyl-4,9-dioxo-1,5-dioxonan-7-yl] 4-methylhexanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:223405

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