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Chemistry, part 3

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > oxygen molecular entity > organooxygen compound > polyketide > 7-(2-hydroxyethyl)-monascorubramine
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > polyketide > 7-(2-hydroxyethyl)-monascorubramine
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organochalcogen compound > organooxygen compound > polyketide > 7-(2-hydroxyethyl)-monascorubramine

Preferred term

7-(2-hydroxyethyl)-monascorubramine  

Type

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

Broader concept

charge

  • 0

formula

  • C25H31NO5

inchi

  • InChI=1S/C25H31NO5/c1-4-6-7-8-9-11-21(28)22-20-15-17-14-18(10-5-2)26(12-13-27)16-19(17)23(29)25(20,3)31-24(22)30/h5,10,14-16,27H,4,6-9,11-13H2,1-3H3/b10-5-/t25-/m0/s1

inchikey

  • NNVANSMEQBWXHJ-UOFFNIIQSA-N

mass

  • 425.525

monoisotopicmass

  • 425.22022

smiles

  • O=C1C=2C(C=C(/C=C/C)N(C2)CCO)=CC=3[C@@]1(OC(=O)C3C(=O)CCCCCCC)C

subset

  • 2_STAR

synonym EXACT

  • 7-(2-hydroxyethyl)-9a-methyl-3-octanoyl-6-[(Z)-prop-1-enyl]uro[3,2-g]isoquinoline-2,9-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:201954

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