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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > sulfur molecular entity > organosulfur compound > glutathione derivative > 7,8-dihydro-7-hydroxy-8s-glutathionylbenzo[a]pyrene
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > glutathione derivative > 7,8-dihydro-7-hydroxy-8s-glutathionylbenzo[a]pyrene
organooxygen compound > glutathione derivative > 7,8-dihydro-7-hydroxy-8s-glutathionylbenzo[a]pyrene

Preferred term

7,8-dihydro-7-hydroxy-8s-glutathionylbenzo[a]pyrene  

Type

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

Broader concept

charge

  • 0

formula

  • C30H29N3O7S

has_parent_hydride

has_role

inchi

  • InChI=1S/C30H29N3O7S/c31-21(30(39)40)9-11-24(34)33-22(29(38)32-13-25(35)36)14-41-23-10-8-18-19-7-6-16-3-1-2-15-4-5-17(27(19)26(15)16)12-20(18)28(23)37/h1-8,10,12,21-23,28,37H,9,11,13-14,31H2,(H,32,38)(H,33,34)(H,35,36)(H,39,40)/t21-,22-,23?,28?/m0/s1

inchikey

  • GODDWIDSELPRPA-QMIJOYDGSA-N

mass

  • 575.63200

monoisotopicmass

  • 575.17262

smiles

  • N[C@@H](CCC(=O)N[C@@H](CSC1C=Cc2c(cc3ccc4cccc5ccc2c3c45)C1O)C(=O)NCC(O)=O)C(O)=O

subset

  • 3_STAR

synonym EXACT

  • L-gamma-glutamyl-S-(7-hydroxy-7,8-dihydrobenzo[pqr]tetraphen-8-yl)-L-cysteinylglycine

synonym RELATED

  • 7,8-Dihydro-7-hydroxy-8-S-glutathionyl-benzo[a]pyrene

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:34479

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