Prosta-5,13-dien-1-oic acid, 9,11,15-trihydroxy-,(5Z,9a,11a,13E,15S)-, compd. with2-amino-2-(hydroxymethyl)-1,3-propanediol (1:1)OTHER CA INDEX NAMES:1,3-Propanediol, 2-amino-2-(hydroxymethyl)-,(5Z,9a,11a,13E,15S)-9,11,15-trihydroxyprosta-5,13-dien-1-oate (salt)


Chemical Name: Prosta-5,13-dien-1-oic acid, 9,11,15-trihydroxy-,(5Z,9a,11a,13E,15S)-, compd. with2-amino-2-(hydroxymethyl)-1,3-propanediol (1:1)OTHER CA INDEX NAMES:1,3-Propanediol, 2-amino-2-(hydroxymethyl)-,(5Z,9a,11a,13E,15S)-9,11,15-trihydroxyprosta-5,13-dien-1-oate (salt)
CAS Number: 38562-01-5
Product Number: AG00BXIN(AGN-PC-0RGV5Q)
Synonyms:
MDL No:
Molecular Formula: C24H45NO8
Molecular Weight: 475.6160

Identification/Properties


Properties
MP:
>99°C (dec.)
BP:
531°C at N/A mmHg
Storage:
Inert atmosphere;-10 ℃;
Form:
Solid
Computed Properties
Molecular Weight:
475.623g/mol
Hydrogen Bond Donor Count:
8
Hydrogen Bond Acceptor Count:
9
Rotatable Bond Count:
15
Exact Mass:
475.315g/mol
Monoisotopic Mass:
475.315g/mol
Topological Polar Surface Area:
185A^2
Heavy Atom Count:
33
Formal Charge:
0
Complexity:
486
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
5
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
2811
Hazard Statements:
H302-H360
Precautionary Statements:
P201-P280-P301+P312+P330-P308+P313
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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