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Chemistry, part 2

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Concept information

organooxygen compound > ether > cyclic ether > epoxide > benzo[a]pyrene diol epoxide i
organooxygen compound > oxacycle > cyclic ether > epoxide > benzo[a]pyrene diol epoxide i
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > cyclic ether > epoxide > benzo[a]pyrene diol epoxide i
... > 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 > cyclic ether > epoxide > benzo[a]pyrene diol epoxide i
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > cyclic ether > epoxide > benzo[a]pyrene diol epoxide i

Preferred term

benzo[a]pyrene diol epoxide i  

Type

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

Broader concept

charge

  • 0

formula

  • C20H14O3

has_parent_hydride

has_role

inchi

  • InChI=1S/C20H14O3/c21-17-13-8-11-5-4-9-2-1-3-10-6-7-12(15(11)14(9)10)16(13)19-20(23-19)18(17)22/h1-8,17-22H

inchikey

  • DQEPMTIXHXSFOR-UHFFFAOYSA-N

mass

  • 302.32336

monoisotopicmass

  • 302.09429

smiles

  • OC1C(O)c2cc3ccc4cccc5ccc(c2C2OC12)c3c45

subset

  • 3_STAR

synonym EXACT

  • 7,8,8a,9a-tetrahydrobenzo[10,11]chryseno[3,4-b]oxirene-7,8-diol
  • 7,8,8a,9a-tetrahydrobenzo[1,12]tetrapheno[10,11-b]oxirene-7,8-diol

synonym RELATED

  • 7,8-Dihydro-7,8-dihydroxybenzo[a]pyrene 9,10-oxide
  • benzo[a]pyrene-7,8-dihydrodiol-9,10-oxide
  • Benzo(a)pyrene diol epoxide
  • benzo(a)pyrene diolepoxide I
  • BP 7,8-Diol-9,10-epoxide 2
  • BPDE

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:30614

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