16,16-Dimethyl prostaglandin D2

(Z)-7-[(1R,2R,5S)-5-hydroxy-2-[(E,3R)-3-hydroxy-4,4-dimethyloct-1-enyl]-3-oxocyclopentyl]hept-5-enoic acid

Also Known As: 16,16-Dimethyl-pgd2|16,16-dimethyl Prostaglandin D2|16,16-Dimethylprostaglandin D2|16,16-dimethyl PGD2|16,16-dimethyl-Prostaglandin D2|16,16-DIMETHYLPROSTAGLANDIND2|1250AH|(Z)-7-[(1R,2R,5S)-5-hydroxy-2-[(E,3R)-3-hydroxy-4,4-dimethyloct-1-enyl]-3-oxocyclopentyl]hept-5-enoic acid|Prosta-5,13-dien-1-oic acid, 9,15-dihydroxy-16,16-dimethyl-11-oxo-, (5Z,9-alpha,13E,15S)-|9S,15S-dihydroxy-11-oxo-16,16-dimethyl-5Z,13E-prostadienoic acid|(5Z,9-alpha,13E,15S)-9,15-Dihydroxy-16,16-dimethyl-11-oxoprosta-5,13-dien-1-oic acid|SR-01000946251-1|Pyrrolidine-1-carbodithioic acid (2E,4E)-hexa-2,4-dienyl ester|9alpha,15R-Dihydroxy-11-oxo-16,16-dimethyl-prosta-5Z,13Edien-1-oic acid|PROSTA-5,13-DIEN-1-OIC ACID, 9,15-DIHYDROXY-16,16-DIMETHYL-11-OXO-, (5Z,9.ALPHA.,13E,15R)-|(5Z,9alpha,13e,15r)-9,15-dihydroxy-16,16-dimethyl-11-oxoprosta-5,13-dien-1-oic acid|9alpha, 15R-dihydroxy-11-oxo-16, 16-dimethyl- prosta-5Z, 13E-dien-1-oic acid|9alpha,15R-Dihydroxy-11-oxo-16,16-dimethyl-prosta-5Z,13E-dien-1-oic acid|(Z)-7-[(1R,2R,5S)-5-hydroxy-2-[(E,3R)-3-hydroxy-4,4-dimethyl-oct-1-enyl]-3-oxo-cyclopentyl]hept-5-enoic acid|PROSTA-5,13-DIEN-1-OIC ACID, 9,15-DIHYDROXY-16,16-DIMETHYL-11-OXO-, (5Z,9ALPHA,13E,15R)-

Molecular Formula	C22H36O5
Molecular Weight	380.2563 g/mol
LogP	3.8872
Topological Polar Surface Area	94.83 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	4
Rotatable Bonds	12
Exact Mass	380.2563
Monoisotopic Mass	380.2563
Heavy Atoms	27
Complexity	534.8212

Chemical Identifiers

CAS Number	85235-22-9
SMILES	CCCCC(C)(C)[C@@H](/C=C/[C@@H]1[C@H]([C@H](CC1=O)O)C/C=C\CCCC(=O)O)O