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Concept information

organooxygen compound > oxacycle > naphthofuran > allahabadolactone a

Preferred term

allahabadolactone a  

Type

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

Broader concept

charge

  • 0

formula

  • C18H26O3

inchi

  • InChI=1S/C18H26O3/c1-11-4-7-14-13(10-11)6-8-15-16(9-5-12(2)19)21-17(20)18(14,15)3/h5-6,8-9,11-16,19H,4,7,10H2,1-3H3/b9-5+/t11-,12+,13-,14-,15+,16+,18+/m1/s1

inchikey

  • CSAGVVBUHTWIPE-QMRAWZHHSA-N

mass

  • 290.403

monoisotopicmass

  • 290.18819

smiles

  • O=C1O[C@@H](/C=C/[C@@H](O)C)[C@H]2[C@@]1([C@H]3[C@H](C=C2)C[C@H](C)CC3)C

subset

  • 2_STAR

synonym EXACT

  • (3S,3aR,5aS,7R,9aR,9bS)-3-[(E,3S)-3-hydroxybut-1-enyl]-7,9b-dimethyl-3,3a,5a,6,7,8,9,9a-octahydrobenzo[g][2]benzouran-1-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:199327

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