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Chemistry, part 2

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Concept information

organooxygen compound > polyketide > macrolide > isomigrastatin
... > organooxygen compound > ester > carboxylic ester > lactone > macrocyclic lactone > macrolide > isomigrastatin
... > organooxygen compound > carbonyl compound > carboxylic ester > lactone > macrocyclic lactone > macrolide > isomigrastatin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > lactone > macrocyclic lactone > macrolide > isomigrastatin
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > lactone > macrocyclic lactone > macrolide > isomigrastatin
... > organooxygen compound > ester > lactone > macrocyclic lactone > macrolide > isomigrastatin
... > organooxygen compound > oxacycle > lactone > macrocyclic lactone > macrolide > isomigrastatin
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > macrocyclic lactone > macrolide > isomigrastatin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > macrocyclic lactone > macrolide > isomigrastatin
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > macrocyclic lactone > macrolide > isomigrastatin
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > macrocycle > macrocyclic lactone > macrolide > isomigrastatin

Preferred term

isomigrastatin  

Type

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

Broader concept

charge

  • 0

formula

  • C27H39NO7

inchi

  • InChI=1S/C27H39NO7/c1-17(21(29)11-9-10-20-15-23(30)28-24(31)16-20)14-18(2)27-19(3)26(33)22(34-4)12-7-5-6-8-13-25(32)35-27/h7-8,12-14,17,19-20,22,26-27,33H,5-6,9-11,15-16H2,1-4H3,(H,28,30,31)/b12-7+,13-8+,18-14+/t17-,19-,22-,26-,27-/m0/s1

inchikey

  • TYTDEHCAAKKYOG-FEJRZXFSSA-N

mass

  • 489.60110

monoisotopicmass

  • 489.27265

smiles

  • CO[C@H]1/C=C/CC/C=C/C(=O)O[C@H]([C@@H](C)[C@@H]1O)C(/C)=C/[C@H](C)C(=O)CCCC1CC(=O)NC(=O)C1

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:80125

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