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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 > organonitrogen heterocyclic compound > benzopyrrole > indoles > indolyl carboxylic acid > a-503451 b
... > organic heterocyclic compound > organonitrogen heterocyclic compound > benzopyrrole > indoles > indolyl carboxylic acid > a-503451 b
... > organic heterocyclic compound > organic heteropolycyclic compound > organic heterobicyclic compound > benzopyrrole > indoles > indolyl carboxylic acid > a-503451 b
organooxygen compound > carbonyl compound > carboxylic acid > indolyl carboxylic acid > a-503451 b
organooxygen compound > carbon oxoacid > carboxylic acid > indolyl carboxylic acid > a-503451 b
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > indolyl carboxylic acid > a-503451 b
... > chemical entity > molecular entity > main group molecular entity > s-block molecular entity > hydrogen molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > indolyl carboxylic acid > a-503451 b

Preferred term

a-503451 b  

Type

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

Broader concept

charge

  • 0

formula

  • C19H27NO4

inchi

  • InChI=1S/C19H27NO4/c1-12(2)13(3)7-8-19(23,11-24-4)17-10-15-9-14(18(21)22)5-6-16(15)20-17/h5-6,9,17,20,23H,7-8,10-11H2,1-4H3,(H,21,22)/t17-,19-/m1/s1

inchikey

  • IBAWHJBEMWQXFJ-IEBWSBKVSA-N

mass

  • 333.428

monoisotopicmass

  • 333.19401

smiles

  • O=C(O)C1=CC2=C(N[C@H](C2)[C@](O)(COC)CCC(=C(C)C)C)C=C1

subset

  • 2_STAR

synonym EXACT

  • (2R)-2-[(2S)-2-hydroxy-1-methoxy-5,6-dimethylhept-5-en-2-yl]-2,3-dihydro-1H-indole-5-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:225623

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