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Chemistry, part 1

Content language

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Concept information

organooxygen compound > ester > carboxylic ester > carbamate ester > kalimantacin c
organooxygen compound > carbonyl compound > carboxylic ester > carbamate ester > kalimantacin c
organooxygen compound > carbonyl compound > carboxylic acid > monocarboxylic acid > kalimantacin c
organooxygen compound > carbon oxoacid > carboxylic acid > monocarboxylic acid > kalimantacin c
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > monocarboxylic acid > kalimantacin c
... > chemical entity > molecular entity > main group molecular entity > s-block molecular entity > hydrogen molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > monocarboxylic acid > kalimantacin c
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > monocarboxylic acid amide > kalimantacin c
organooxygen compound > carboxamide > monocarboxylic acid amide > kalimantacin c
... > 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 > kalimantacin c
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > fatty acid derivative > kalimantacin c

Preferred term

kalimantacin c  

Type

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

Broader concept

charge

  • 0

formula

  • C29H46N2O7

has_role

inchi

  • InChI=1S/C29H46N2O7/c1-20(13-22(3)14-23(4)16-28(35)36)11-9-7-6-8-10-12-21(2)15-25(32)18-26(33)19-31-27(34)17-24(5)38-29(30)37/h6-8,10,16,21-22,24,26,33H,1,9,11-15,17-19H2,2-5H3,(H2,30,37)(H,31,34)(H,35,36)/b7-6-,10-8+,23-16+

inchikey

  • VWVAAKIWHSCMIW-YHKKGOIFSA-N

mass

  • 534.68470

monoisotopicmass

  • 534.33050

smiles

  • CC(C/C=C/C=C/CCC(=C)CC(C)C/C(C)=C/C(O)=O)CC(=O)CC(O)CNC(=O)CC(C)OC(N)=O

subset

  • 3_STAR

synonym EXACT

  • (2E,10Z,12E)-20-{[3-(carbamoyloxy)butanoyl]amino}-19-hydroxy-3,5,15-trimethyl-7-methylidene-17-oxoicosa-2,10,12-trienoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:66137

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