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15-Keto Prostaglandin E1

CAT: 1596-AR-P03167-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-P03167-01Size:10 Units
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
22973-19-9
Synonyms
7- ((1R,2R,3R) -3-hydroxy-5-oxo-2- ((E) -3-oxooct-1-en-1-yl) cyclopentyl) heptanoic acid; (11?,13E) -11-Hydroxy-9,15-dioxo-prost-13-en-1-oic Acid;3-Hydroxy-5-oxo-2- (3-oxo-1-octenyl) -cyclopentaneheptanoic Acid; 15-Keto-PGE1;15-Oxo-PGE1; 15-Oxoprostaglandin E1; 15-Keto Prostaglandin E1
Molecular Formula
C20H32O5
Molecular Weight
352.48
API Name
Prostaglandin

Chemical Information

(11alpha,13E)-11-Hydroxy-9,15-dioxoprost-13-en-1-oic acid

15-dehydro-prostaglandin E1 is a prostaglandins E. It is functionally related to a prostaglandin E1. It is a conjugate acid of a 15-dehydro-prostaglandin E1(1-).

CAS Number22973-19-9
PubChem CID5280710
IUPAC Name7-[(1R,2R,3R)-3-hydroxy-5-oxo-2-[(E)-3-oxooct-1-enyl]cyclopentyl]heptanoic acid
Molecular FormulaC20H32O5
Molecular Weight352.5
XLogP3.1
Topological Polar Surface Area91.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count13
Heavy Atom Count25
Formal Charge0
Complexity469
SMILES
CCCCCC(=O)/C=C/[C@H]1[C@@H](CC(=O)[C@@H]1CCCCCCC(=O)O)O
InChI
InChI=1S/C20H32O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h12-13,16-17,19,23H,2-11,14H2,1H3,(H,24,25)/b13-12+/t16-,17-,19-/m1/s1
InChIKey
VXPBDCBTMSKCKZ-XQHNHVHJSA-N
Chemical Structure
2D Structure
2D structure of (11alpha,13E)-11-Hydroxy-9,15-dioxoprost-13-en-1-oic acid
CAS: 22973-19-9
CID: 5280710
Formula: C20H32O5
MW: 352.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight352.5
XLogP33.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count13
Exact Mass352.22497412
Monoisotopic Mass352.22497412
Topological Polar Surface Area91.7 Ų
Heavy Atom Count25
Formal Charge0
Complexity469
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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