prostaglandin D2
(Z)-7-[(1R,2R,5S)-5-hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]-3-oxocyclopentyl]hept-5-enoic acid
Molecular Identity
prostaglandin D2
(Z)-7-[(1R,2R,5S)-5-hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]-3-oxocyclopentyl]hept-5-enoic acid
PubChem CID: 448457
Prostaglandin D2 is a member of the class of prostaglandins D that is prosta-5,13-dien-1-oic acid substituted by hydroxy groups at positions 9 and 15 and an oxo group at position 11 (the 5Z,9alpha,13E,15S- stereoisomer). It has a role as a mouse metabolite and a human metabolite. It is a conjugate acid of a prostaglandin D2(1-).
2D Structure
Properties
C20H32O5
Molecular Formula
352.50
Molecular Weight
g/mol
352.2250
Exact Mass
Da
2.6
XLogP
Drug-like (Lipinski: < 5)
94.8
TPSA
Good oral absorption (< 140 A²)
3
H-Bond Donors
5
H-Bond Acceptors
469
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
prostaglandin D2PGD241598-07-611-Dehydroprostaglandin F2-alpha11-Dehydroprostaglandin F2alphaBRN 2170623RXY07S6CZ2(5Z,13E,15S)-9alpha,15-Dihydroxy-11-oxoprosta-5,13-dienoate11-Dehydroprostaglandin F2 alphaDTXSID30897162(Z)-7-[(1R,2R,5S)-5-hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]-3-oxocyclopentyl]hept-5-enoic acid(5Z,13E)-(15S)-9alpha,15-Dihydroxy-11-oxoprosta-5,13-dienoate9S,15S-dihydroxy-11-oxo-5Z,13E-prostadienoic acidCHEBI:15555(5Z,13E,15S)-9alpha,15-dihydroxy-11-oxoprosta-5,13-dien-1-oic acid
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to prostaglandin D2
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