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Prostaglandin F2alpha-1,11-lactone

HCID 5771740
NotesReactions
Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
62410-84-8
Standard SMILES
CCCCC[C@H](O)/C=C/[C@@H]1[C@H]2C/C=C\CCCC(=O)O[C@@H]1C[C@@H]2O
InChIKey
KBFCVOAVUKWCPS-YNNPMVKQSA-N
Molecular formula
C20H32O4
Average molar mass
336.5 g/mol
Monoisotopic mass
336.2300595

Overview

Prostaglandin F2alpha 1-11-lactone is a prostanoid.

Names & identifiers

Preferred name
Prostaglandin F2alpha-1,11-lactone
IUPAC
(1R,7Z,10R,11S,13R)-11-hydroxy-13-[(E,3S)-3-hydroxyoct-1-enyl]-2-oxabicyclo[8.2.1]tridec-7-en-3-one
English name
9alpha, 11alpha, 15S-trihydroxy-prosta-5z, 13e-dien-1-oic acid, 1,11-lactone
Molecular formula
C20H32O4
Molecular weight
336.47

Names & synonyms

62410-84-8Prostaglandin F2|A 1,11-lactoneProstaglandin F2alpha 1,11-lactoneProstaglandin F2alpha-1,11-lactonePGF2alpha-1,11-lactone(1R,7Z,10R,11S,13R)-11-hydroxy-13-[(E,3S)-3-hydroxyoct-1-enyl]-2-oxabicyclo[8.2.1]tridec-7-en-3-one9S,15S-dihydroxy-5Z,13E-prostadienoic acid-1,11R-lactoneLMFA03010071PGF2alpha 1,11-lactoneDWR9BA97Y8orb1692984EX-A8005C
Show more names
Brn 5596377pgf2-alpha1,11-lactoneProstaglandin F2α 1,11-lactone9,11,15-trihydroxy-,iota-lactone,(5z,9-alpha,11-prosta-13-dien-1-oicacidProsta-5,13-dien-1-oicacid,9,11,15-trihydroxy-,i-lactone,(5z,9a,11a,13e,15s)-(9ci)Prosta-5,13-dien-1-oic acid, 9,11,15-trihydroxy-, ι-lactone, (5Z,9α,11α,13E,15S)- (9CI)Prosta-5,13-dien-1-oic acid, 9,11,15-trihydroxy-, iota-lactone, (5Z,9-alpha,11-alpha,13E,15S)-(1R,3Z,10R,12S,13R)-12-hydroxy-13-[(E,3S)-3-hydroxyoct-1-enyl]-9-oxabicyclo[8.2.1]tridec-3-en-8-one

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
66.8 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
24
Formal charge
0
Complexity
443

Experimental & physicochemical properties

LipidsFatty Acyls [FA] -> Eicosanoids [FA03] -> Prostaglandins [FA0301]

Physicochemical properties

Boiling point
516.204 · 516.204±50.00 °C(Press: 760.00 Torr)(predicted)
Density
1.1 · 1.100±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
storage temp.
-20 °C · Store at -20°C
solubility
20 mg/ml; · DMF: >20 mg/ml; DMSO: >10 mg/ml; Ethanol: >100 mg/ml; Ethanol:PBS (30:70): 8 mg/ml; PBS pH 7.2: <50 μg/ml
pka
14.274 · 14.274±0.40(predicted)
EWG's Food Scores
1 · 1
Symbol(GHS)
2 · GHS02,GHS07,GHS08
Signal word
Danger
Hazard statements
225 · H225-H319-H360-H336
Precautionary statements
201 · P201-P202-P210-P240-P241-P242-P243-P261-P264-P271-P280-P303+P361+P353-P304+P340-P305+P351+P338-P308+P313-P312-P337+P313-P370+P378-P403+P233-P403+P235-P405-P501

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Signal word
Danger
Symbol(GHS)
GHS02,GHS07,GHS08
Hazard statements
H225-H319-H360-H336
Precautionary statements
P201-P202-P210-P240-P241-P242-P243-P261-P264-P271-P280-P303+P361+P353-P304+P340-P305+P351+P338-P308+P313-P312-P337+P313-P370+P378-P403+P233-P403+P235-P405-P501

Chemistry & industry

Applications · 1 item

UsesProstaglandin F2α 1,11-lactone is a prostaglandin. Prostaglandin F2α 1,11-lactone is absorbed by the eye. Prostaglandin F2α 1, 11-Lactone has metabolic stability on the corneal surface and conjunctiva. Prostaglandin F2α 1,11-lactone can be used in the treatment of glaucoma [1].

Suppliers7 total

上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
南通全益生物科技有限公司0513-66337626 18051384581 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
上海立崎生物医学研究中心18014399201 · [email protected]
上海宏叶生物科技有限公司400-9205774 400-920-5774 · [email protected]
TargetMol中国(陶术生物)4008200310 15002144251 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
CHEBI:167814HMS3648P15Prostaglandin F2alpha 1-11-lactoneMFCD008926409alpha, 11alpha, 15S-Trihydroxy-prosta-5Z, 13E-dien-1-oic acid, 1,11-lactoneHY-131617CS-0137667SR-01000946469

Database identifiers

CAS
62410-84-8
PubChem CID
5771740
ChEBI
CHEBI:167814
UNII
DWR9BA97Y8