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Chemistry, part 1

Content language

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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 > splenocin i
organooxygen compound > carboxamide > monocarboxylic acid amide > amidobenzoic acid > splenocin i
... > 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 > splenocin i
... > organooxygen compound > carbonyl compound > carboxylic acid > aromatic carboxylic acid > benzoic acids > amidobenzoic acid > splenocin i
... > organooxygen compound > carbon oxoacid > carboxylic acid > aromatic carboxylic acid > benzoic acids > amidobenzoic acid > splenocin i
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > aromatic carboxylic acid > benzoic acids > amidobenzoic acid > splenocin i
... > 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 > splenocin i
organic aromatic compound > aromatic carboxylic acid > benzoic acids > amidobenzoic acid > splenocin i

Preferred term

splenocin i  

Type

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

Broader concept

charge

  • 0

formula

  • C31H30N2O9

inchi

  • InChI=1S/C31H30N2O9/c1-18-25(33-28(36)22-14-9-15-24(26(22)35)32-17-34)31(39)41-19(2)27(42-29(37)21-12-7-4-8-13-21)23(30(38)40-18)16-20-10-5-3-6-11-20/h3-15,17-19,23,25,27,35H,16H2,1-2H3,(H,32,34)(H,33,36)/t18-,19+,23-,25+,27+/m1/s1

inchikey

  • CDFGTWCLDDDNOL-YMWAZFFASA-N

mass

  • 574.586

monoisotopicmass

  • 574.19513

smiles

  • O=C1O[C@H]([C@H](OC(=O)C2=CC=CC=C2)[C@@H](CC3=CC=CC=C3)C(O[C@@H]([C@@H]1NC(=O)C4=C(O)C(NC=O)=CC=C4)C)=O)C

subset

  • 2_STAR

synonym EXACT

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

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:215592

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