PDND
Phytochemical Database for Neurological Disorders
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Phytochemical Name : Reynosin
PCNDIDR0019
Pubchem CID : 482788
Molecular formula: C15H20O3

Molecular weight : 248.320

Canonical SMILES : CC12CCC3C(C1C(=C)CCC2O)OC(=O)C3=C

Synonymes : Reynosin|28254-53-7|(+)-reynosin|UNII-N26569L9V4|CHEBI:540787|N26569L9V4|NSC 155623|(3aS)-3a,4,5,5a,6,7,8,9,9abeta,9balpha-decahydro-6alpha-hydroxy-5aalpha-methyl-3,9-bis(methylene)naphtho[1,2-b]furan-2(3H)-one|(3aS,5aR,6R,9aS,9bS)-6-hydroxy-5a-methyl-3,9-bis(methylene)decahydronaphtho[1,2-b]furan-2(3H)-one|(3aS,5aR,6R,9aS,9bS)-6-hydroxy-5a-methyl-3,9-dimethylenedecahydronaphtho[1,2-b]furan-2(3H)-one|(3aS,5aR,6R,9aS,9bS)-6-Hydroxy-5a-methyl-3,9-dimethylenedecahydronaphtho[1,2-b]furan-2(9bH)-one|(3aS,9abeta,9balpha)-3a,4,5,5a,6,7,8,9,9a,9b-decahydro-6alpha-hydroxy-5aalpha-methyl-3,9-bis(methylene)naphtho[1,2-b]furan-2(3H)-one|NSC-155623|(3aS,5aR,6R,9aS,9bS)-6-hydroxy-5a-methyl-3,9-dimethylidene-3a,4,5,6,7,8,9a,9b-octahydrobenzo[g][1]benzofuran-2-one|(+)-Reynosin; NSC 155623; Reinosin|REINOSIN|REYNOSIN, (+)-|CHEMBL272178|SCHEMBL1683362|AKOS032948484|NCGC00385273-01|Q27105167|(3aS,5aR,6R,9aS,9bS)-6-hydroxy-5a-methyl-3,9-dimethylene-3a,4,5,6,7,8,9a,9b-octahydrobenzo[g]benzofuran-2-one|(3aS,5aR,6R,9aS,9bS)-6-hydroxy-5a-methyl-3,9-dimethylidene-dodecahydronaphtho[1,2-b]furan-2-one|EUDESMA-4(14),11(13)-DIEN-12-OIC ACID, 1.BETA.,6.ALPHA.-DIHYDROXY-, .GAMMA.-LACTONE|NAPHTHO(1,2-B)FURAN-2(3H)-ONE, DECAHYDRO-6-HYDROXY-5A-METHYL-3,9-BIS(METHYLENE)-, (3AS,5AR,6R,9AS,9BS)-|NAPHTHO(1,2-B)FURAN-2(3H)-ONE, DECAHYDRO-6-HYDROXY-5A-METHYL-3,9-BIS(METHYLENE)-, (3AS-(3A.ALPHA.,5A.BETA.,6.BETA.,9A.ALPHA.,9B.BETA.))-|Naphtho(1,2-b)furan-2(3H)-one, decahydro-6-hydroxy-5a-methyl-3,9-bis(methylene)-, (3aS-(3aalpha,5abeta,6beta,9aalpha,9bbeta))-|Naphthol[1,2-b]furan-2(3H)-one,decahydro-6-hydroxy-5a-methyl-3,9-bis(methylene)-,[3as-(3aalpha,5abeta,6beta,9aalpha,9bbeta)]

Structure
3D structure 2D structure
482788
Predicted properties (NCBI Pubchem)

Physicochemical Properties