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Chemistry, part 2

Content language

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Concept information

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

Preferred term

pestalrone b  

Type

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

Broader concept

charge

  • 0

formula

  • C11H18O4

inchi

  • InChI=1S/C11H18O4/c1-3-4-5-6-11(13-2)7-8-9(14-8)10(12)15-11/h8-9H,3-7H2,1-2H3/t8-,9-,11+/m1/s1

inchikey

  • NINCXQRSQVSCLG-KKZNHRDASA-N

mass

  • 214.261

monoisotopicmass

  • 214.12051

smiles

  • O=C1O[C@](OC)(C[C@@H]2[C@H]1O2)CCCCC

subset

  • 2_STAR

synonym EXACT

  • (1R,4S,6R)-4-methoxy-4-pentyl-3,7-dioxabicyclo[4.1.0]heptan-2-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:199535

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