Prostaglandin D2

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Names

[ CAS No. ]:
41598-07-6

[ Name ]:
Prostaglandin D2

[Synonym ]:
PGD2
(5Z,9α,13E,15S)-9,15-Dihydroxy-11-oxoprosta-5,13-dien-1-oic acid
Prosta-5,13-dien-1-oic acid, 9,15-dihydroxy-11-oxo-, (5Z,9α,13E,15S)-
Prostaglandin D2
(5Z,9α,13E,15S)-9,15-dihydroxy-11-oxo-prosta-5,13-dien-1-oic acid
MFCD00077857

Chemical & Physical Properties

[ Density]:
1.1±0.1 g/cm3

[ Boiling Point ]:
549.6±50.0 °C at 760 mmHg

[ Molecular Formula ]:
C20H32O5

[ Molecular Weight ]:
352.465

[ Flash Point ]:
300.3±26.6 °C

[ Exact Mass ]:
352.224976

[ PSA ]:
94.83000

[ LogP ]:
2.02

[ Vapour Pressure ]:
0.0±3.4 mmHg at 25°C

[ Index of Refraction ]:
1.561

[ Storage condition ]:
20°C

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UK7930000
CHEMICAL NAME :
Prosta-5,13-dien-1-oic acid, 9,15-dihydroxy-11-oxo-, (5Z,9-alpha,13E,15S)-
CAS REGISTRY NUMBER :
41598-07-6
LAST UPDATED :
199612
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C20-H32-O5
MOLECULAR WEIGHT :
352.52
WISWESSER LINE NOTATION :
T5VTJ B1U7 C2U4VQ DQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Subcutaneous
DOSE :
400 ug/kg
SEX/DURATION :
female 4 day(s) after conception
TOXIC EFFECTS :
Reproductive - Fertility - female fertility index (e.g. # females pregnant per # sperm positive females; # females pregnant per # females mated)

MUTATION DATA

TYPE OF TEST :
Mutation test systems - not otherwise specified
TEST SYSTEM :
Rodent - mouse Cells - not otherwise specified
DOSE/DURATION :
5 mg/L/24H
REFERENCE :
CNREA8 Cancer Research. (Public Ledger Building, Suit 816, 6th & Chestnut Sts., Philadelphia, PA 19106) V.1- 1941- Volume(issue)/page/year: 46,1688,1986

Safety Information

[ Symbol ]:

GHS07, GHS08

[ Signal Word ]:
Danger

[ Hazard Statements ]:
H302-H360

[ Precautionary Statements ]:
P201-P308 + P313

[ Personal Protective Equipment ]:
Eyeshields;full-face particle respirator type N100 (US);Gloves;respirator cartridge type N100 (US);type P1 (EN143) respirator filter;type P3 (EN 143) respirator cartridges

[ Hazard Codes ]:
T: Toxic;

[ Risk Phrases ]:
60-22

[ Safety Phrases ]:
S22;S26;S36;S53

[ RIDADR ]:
NONH for all modes of transport

[ RTECS ]:
UK7930000

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • (5Z,13E)-9α-[(tert-butyldimethylsilyl)oxy]-11-oxo-15-[(tert-butyldiphenylsilyl)oxy]prosta-5,13-dienoic acid
  • (R)-(-)-BENZOIN
  • methyl 7-oxohept-5-ynoate
  • (1E)-iodo-(3S)-(tetrahydro-2H-pyran-2-yloxy)-1-octene

DownStream

  • 9ALPHA, 11ALPHA, 15S-TRIHYDROXY-PROSTA-5Z, 13E-DIEN-1-OIC ACID, 1,11-LACTONE

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The Human Metabolome Database (HMDB, http://www.hmdb.ca) is a richly annotated resource that is designed to address the broad needs of biochemists, clinical chemists, physicians, medical geneticists, ...

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Related Compounds

  • Prostaglandin D2-d4
  • 15(R)-Prostaglandin D2
  • DELTA12-PROSTAGLANDIN D2
  • Prostaglandin D2 methyl ester
  • Prostaglandin D2 1,15-lactone
  • Prostaglandin D2 Ethanolamide