chempirical

Dinoprost tromethamine

C24H45NO8CAS 38562-01-5475.62 g/mol

Open in Covalent MOL file
HOOOHOHHONH2HOHOOH
AlcoholAlkeneCarboxylic acidPrimary amine

Properties

Molecular formula
C24H45NO8
Molar mass
475.62 g/mol
Exact mass
475.3145 Da
Melting point
25–35 °C
logP
0.70Crippen estimate
Polar surface area
184.7 Ų
H-bond donors / acceptors
8 / 8
Rotatable bonds
15
Stereocentres
S, R, R, S, Rin SMILES atom order
Double bonds
EE/Z, in SMILES order

Identifiers

CAS number
38562-01-5
SMILES
CCCCC[C@H](O)/C=C/[C@@H]1[C@@H](C/C=CCCCC(=O)O)[C@@H](O)C[C@H]1O.NC(CO)(CO)CO
InChIKey
IYGXEHDCSOYNKY-RZHHZEQLSA-N
InChI
InChI=1S/C20H34O5.C4H11NO3/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;5-4(1-6,2-7)3-8/h4,7,12-13,15-19,21-23H,2-3,5-6,8-11,14H2,1H3,(H,24,25);6-8H,1-3,5H2/b7-4-,13-12+;/t15-,16+,17+,18-,19+;/m0./s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

26 names · show all
  • Prosta-5,13-dien-1-oic acid, 9,11,15-trihydroxy-, (5Z,9α,11α,13E,15S)-, compd. with 2-amino-2-(hydroxymethyl)-1,3-propanediol (1:1)
  • 1,3-Propanediol, 2-amino-2-(hydroxymethyl)-, (5Z,9α,11α,13E,15S)-9,11,15-trihydroxyprosta-5,13-dien-1-oate (salt)
  • Prostaglandin F2α THAM salt
  • Prostaglandin F2α tromethamine salt
  • Prostaglandin F2α tromethamine
  • THAM PGF2α
  • Tromethamine prostaglandin F2α
  • PGF2α THAM
  • PGF2α THAM salt
  • PGF2α tromethamine salt
  • Prostaglandin F2α tris(hydroxymethyl)aminomethane salt
  • U 14585
  • PGF2α Tris salt
  • Prostaglandin F2α-tham
  • PGF2α tromethamine
  • Lutalyse
  • U 14583E
  • Minprostin F2α
  • Prostaglandin F2α tris(hydroxymethyl)aminomethane
  • Dinolytic
  • Pronalgon F
  • Prostaglandin F2a tromethamine salt
  • NSC 196515
  • Lutalyze
  • Enzaprost T
  • Dinoprost trometamol

Work with Dinoprost tromethamine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Prostaglandin F2551-11-183 % similar Carboprost tromethamine58551-69-273 % similar Carboprost35700-23-360 % similar Prostaglandin E2363-24-659 % similar Prostacyclin35121-78-956 % similar Leukotriene B471160-24-253 % similar Cloprostenol40665-92-753 % similar D-Cloprostenol54276-21-053 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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