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Concept information

organooxygen compound > oxacycle > benzofurans > methyl 3-(4,5,6,8,8a,9-hexahydro-4-((e)-3-methylpent-1-enyl)-4h-furo[3,2-g]isochromen-6-yl)propanoate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > benzofurans > methyl 3-(4,5,6,8,8a,9-hexahydro-4-((e)-3-methylpent-1-enyl)-4h-furo[3,2-g]isochromen-6-yl)propanoate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > benzofurans > methyl 3-(4,5,6,8,8a,9-hexahydro-4-((e)-3-methylpent-1-enyl)-4h-furo[3,2-g]isochromen-6-yl)propanoate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > benzofurans > methyl 3-(4,5,6,8,8a,9-hexahydro-4-((e)-3-methylpent-1-enyl)-4h-furo[3,2-g]isochromen-6-yl)propanoate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > benzofurans > methyl 3-(4,5,6,8,8a,9-hexahydro-4-((e)-3-methylpent-1-enyl)-4h-furo[3,2-g]isochromen-6-yl)propanoate

Preferred term

methyl 3-(4,5,6,8,8a,9-hexahydro-4-((e)-3-methylpent-1-enyl)-4h-furo[3,2-g]isochromen-6-yl)propanoate  

Type

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

Broader concept

charge

  • 0

formula

  • C21H30O4

inchi

  • InChI=1S/C21H30O4/c1-4-14(2)5-7-17-18-9-10-24-20(18)11-15-13-25-16(12-19(15)17)6-8-21(22)23-3/h5,7,9-10,14-17,19H,4,6,8,11-13H2,1-3H3/b7-5+/t14?,15-,16+,17+,19-/m1/s1

inchikey

  • LBBXLAVURLOGQS-OVHXUYRLSA-N

mass

  • 346.467

monoisotopicmass

  • 346.21441

smiles

  • O=C(OC)CC[C@@H]1OC[C@H]2CC=3OC=CC3[C@@H]([C@@H]2C1)/C=C/C(CC)C

subset

  • 2_STAR

synonym EXACT

  • methyl 3-[(4R,4aS,6S,8aS)-4-[(E)-3-methylpent-1-enyl]-4a,5,6,8,8a,9-hexahydro-4H-uro[3,2-g]isochromen-6-yl]propanoate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:215064

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