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Chemistry, part 1

Content language

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Concept information

... > organooxygen compound > ester > carboxylic ester > lactone > cyclodepsipeptide > isariin b
... > organooxygen compound > carbonyl compound > carboxylic ester > lactone > cyclodepsipeptide > isariin b
organooxygen compound > ester > lactone > cyclodepsipeptide > isariin b
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > peptide > depsipeptide > cyclodepsipeptide > isariin b
... > organooxygen compound > carboxamide > peptide > depsipeptide > cyclodepsipeptide > isariin b
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > peptide > depsipeptide > cyclodepsipeptide > isariin b
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic amino compound > peptide > depsipeptide > cyclodepsipeptide > isariin b
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > peptide > depsipeptide > cyclodepsipeptide > isariin b

Preferred term

isariin b  

Type

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

Broader concept

charge

  • 0

formula

  • C30H53N5O7

inchi

  • InChI=1S/C30H53N5O7/c1-9-10-11-12-13-21-15-23(36)31-16-24(37)34-25(18(4)5)29(40)33-22(14-17(2)3)28(39)32-20(8)27(38)35-26(19(6)7)30(41)42-21/h17-22,25-26H,9-16H2,1-8H3,(H,31,36)(H,32,39)(H,33,40)(H,34,37)(H,35,38)/t20-,21-,22+,25+,26+/m0/s1

inchikey

  • QWBKHPNGPXORRV-WQVMVKNYSA-N

mass

  • 595.782

monoisotopicmass

  • 595.39450

smiles

  • O=C1O[C@H](CC(=O)NCC(=O)N[C@H](C(C)C)C(N[C@@H](C(N[C@H](C(N[C@@H]1C(C)C)=O)C)=O)CC(C)C)=O)CCCCCC

subset

  • 2_STAR

synonym EXACT

  • (3R,6S,9R,12R,19S)-19-hexyl-6-methyl-9-(2-methylpropyl)-3,12-di(propan-2-yl)-1-oxa-4,7,10,13,16-pentazacyclononadecane-2,5,8,11,14,17-hexone

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:223411

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