Secondary metabolite:5,5,8a-Trimethyl-3,5,6,7,8,8a-hexahydro-2H-chromene



EOCID001571
Summary

sCentInDB Chemical identifier: EOCID001571

Chemical name: 5,5,8a-Trimethyl-3,5,6,7,8,8a-hexahydro-2H-chromene

Molecular formula: C12H20O

SMILES: CC1(C)CCCC2(C1=CCCO2)C

InChI: InChI=1S/C12H20O/c1-11(2)7-5-8-12(3)10(11)6-4-9-13-12/h6H,4-5,7-9H2,1-3H3

InChIKey: IKVLZMXNHQYWMF-UHFFFAOYSA-N


Chemical classification

Kingdom: Organic compounds

Superclass: Organoheterocyclic compounds

Class: Benzopyrans

Subclass:


Synonymous chemical name(s):
5,5,8a-trimethyl-3,5,6,7,8,8a-hexahydro-2h-chromene


External chemical identifier(s):
CID:580068, CHEMSPIDER:504216, SURECHEMBL:SCHEMBL2698273


Spectrabase ID:
4995P2l7muh


Chemical structure download

2D:2D MOL2D MOL22D SDF
3D:3D MOL3D MOL23D SDF3D PDB3D PDBQT
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