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Chemistry, part 2

Content language

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Concept information

organooxygen compound > oxacycle > oxyisocyclointegrin
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > oxyisocyclointegrin
... > 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 > oxyisocyclointegrin
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > oxyisocyclointegrin

Preferred term

oxyisocyclointegrin  

Type

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

Broader concept

charge

  • 0

formula

  • C21H20O7

inchi

  • InChI=1S/C21H20O7/c1-21(2,25)17-9-13-19(24)18-14(23)7-11(26-3)8-16(18)28-20(13)12-5-4-10(22)6-15(12)27-17/h4-8,17,22-23,25H,9H2,1-3H3

inchikey

  • CLBXZXANZHXYLN-UHFFFAOYSA-N

mass

  • 384.384

monoisotopicmass

  • 384.12090

smiles

  • O1C(C(O)(C)C)CC2=C(OC=3C(C2=O)=C(O)C=C(OC)C3)C4=C1C=C(O)C=C4

subset

  • 2_STAR

synonym EXACT

  • 3,9-dihydroxy-6-(2-hydroxypropan-2-yl)-11-methoxy-6,7-dihydrochromeno[3,2-d][1]benzoxepin-8-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:175892

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