Portulal

(1R,2R,3aS,8aR)-1-[(Z)-5-hydroxy-3-(hydroxymethyl)pent-3-enyl]-1-(hydroxymethyl)-2,5-dimethyl-2,3,4,7,8,8a-hexahydroazulene-3a-carbaldehyde

Also Known As: Portulal|natural portulal|(1R,2R,3aS,8aR)-1-[(Z)-5-hydroxy-3-(hydroxymethyl)pent-3-enyl]-1-(hydroxymethyl)-2,5-dimethyl-2,3,4,7,8,8a-hexahydroazulene-3a-carbaldehyde|(1R)-1,2,3,3a,4,7,8,8abeta-Octahydro-1-[(Z)-5-hydroxy-3-hydroxymethyl-3-pentenyl]-1alpha-hydroxymethyl-2alpha,5-dimethyl-3abeta-azulenecarbaldehyde|(1R,2R,3aS,8aR)-1-[(3Z)-5-hydroxy-3-(hydroxymethyl)pent-3-en-1-yl]-1-(hydroxymethyl)-2,5-dimethyl-1,2,3,3a,4,7,8,8a-octahydroazulene-3a-carbaldehyde|(1R,2R,3aS,8aR)-2,3,4,7,8,8a-Hexahydro-1-((3Z)-5-hydroxy-3-(hydroxymethyl)-3-penten-1-yl)-1-(hydroxymethyl)-2,5-dimethyl-3a(1H)-azulenecarboxaldehyde|(1R,2R,3aS,8aR)-2,3,4,7,8,8a-Hexahydro-1-[(3Z)-5-hydroxy-3-(hydroxymethyl)-3-penten-1-yl]-1-(hydroxymethyl)-2,5-dimethyl-3a(1H)-azulenecarboxaldehyde

Molecular Formula	C20H32O4
Molecular Weight	336.23007 g/mol
LogP	2.6278
Topological Polar Surface Area	77.76 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	4
Rotatable Bonds	7
Exact Mass	336.23007
Monoisotopic Mass	336.23007
Heavy Atoms	24
Complexity	509.76825

Chemical Identifiers

CAS Number	22571-65-9
SMILES	C[C@@H]1C[C@@]2(CC(=CCC[C@@H]2[C@]1(CC/C(=C/CO)/CO)CO)C)C=O