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Chemistry, part 2

Content language

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Concept information

organooxygen compound > oxacycle > nf00659a1
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > nf00659a1
... > 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 > nf00659a1
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > nf00659a1

Preferred term

nf00659a1  

Type

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

Broader concept

charge

  • 0

formula

  • C36H52O7

inchi

  • InChI=1S/C36H52O7/c1-10-21(2)13-11-12-14-31(38)42-29-15-18-36(9)28-20-27(37)23(4)26(19-25-32(39)22(3)24(5)41-33(25)40)35(28,8)17-16-30(36)43-34(29,6)7/h11-14,21,26-30,37,39H,4,10,15-20H2,1-3,5-9H3/b13-11+,14-12+

inchikey

  • GLJUDWCQRLSFDX-PHEQNACWSA-N

mass

  • 596.805

monoisotopicmass

  • 596.37130

smiles

  • O=C1OC(=C(C)C(=C1CC2C(=C)C(O)CC3C2(CCC4C3(CCC(OC(=O)/C=C/C=C/C(CC)C)C(O4)(C)C)C)C)O)C

subset

  • 2_STAR

synonym EXACT

  • [10-hydroxy-8-[(4-hydroxy-5,6-dimethyl-2-oxopyran-3-yl)methyl]-4,4,7a,11b-tetramethyl-9-methylidene-1,2,3,5a,6,7,8,10,11,11a-decahydronaphtho[2,1-b]oxepin-3-yl] (2E,4E)-6-methylocta-2,4-dienoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:198749

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