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Chemistry, part 2

Content language

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Concept information

organooxygen compound > oxacycle > benzopyran > 2-benzopyran > nigrospin c
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > benzopyran > 2-benzopyran > nigrospin c
... > 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 > benzopyran > 2-benzopyran > nigrospin c
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > benzopyran > 2-benzopyran > nigrospin c
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > benzopyran > 2-benzopyran > nigrospin c
... > 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 > organic heteropolycyclic compound > benzopyran > 2-benzopyran > nigrospin c
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > benzopyran > 2-benzopyran > nigrospin c

Preferred term

nigrospin c  

Type

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

Broader concept

charge

  • 0

formula

  • C18H26O5

inchi

  • InChI=1S/C18H26O5/c1-9-11(3)23-15(6-12(19)8-18(4,5)22)17-14(21)7-13(20)10(2)16(9)17/h7,9,11,15,20-22H,6,8H2,1-5H3/t9-,11-,15-/m1/s1

inchikey

  • AUMRYRUPFUTXDO-XDMRBOTDSA-N

mass

  • 322.401

monoisotopicmass

  • 322.17802

smiles

  • O=C(CC(O)(C)C)C[C@H]1O[C@@H]([C@@H](C)C=2C1=C(O)C=C(O)C2C)C

subset

  • 2_STAR

synonym EXACT

  • 1-[(1R,3R,4S)-6,8-dihydroxy-3,4,5-trimethyl-3,4-dihydro-1H-isochromen-1-yl]-4-hydroxy-4-methylpentan-2-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:199457

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