2-Piperidinecarboxylic acid,1-[oxo[tetrahydro-2-hydroxy-6-[14-hydroxy-22-(4-hydroxy-3-methoxycyclohexyl)-2,13-dimethoxy-3,9,11,15,17,21-hexamethyl-12,18-dioxo-3,5,7,15,19-docosapentaenyl]-3-methyl-2H-pyran-2-yl]acetyl]-, monosodiumsalt,[2R-[2a,2(S*),3a,6b[2S*,3E,5E,7E,9S*,11R*,13R*,14R*,15E,17R*,19E,21R*,22(1S*,3R*,4R*)]]]-


Chemical Name: 2-Piperidinecarboxylic acid,1-[oxo[tetrahydro-2-hydroxy-6-[14-hydroxy-22-(4-hydroxy-3-methoxycyclohexyl)-2,13-dimethoxy-3,9,11,15,17,21-hexamethyl-12,18-dioxo-3,5,7,15,19-docosapentaenyl]-3-methyl-2H-pyran-2-yl]acetyl]-, monosodiumsalt,[2R-[2a,2(S*),3a,6b[2S*,3E,5E,7E,9S*,11R*,13R*,14R*,15E,17R*,19E,21R*,22(1S*,3R*,4R*)]]]-
CAS Number: 148554-65-8
Product Number: AG001L0I(AGN-PC-0Q2074)
Synonyms:
MDL No:
Molecular Formula: C51H78NNaO13
Molecular Weight: 936.1537

Identification/Properties


Computed Properties
Molecular Weight:
936.169g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
13
Rotatable Bond Count:
24
Exact Mass:
935.537g/mol
Monoisotopic Mass:
935.537g/mol
Topological Polar Surface Area:
209A^2
Heavy Atom Count:
66
Formal Charge:
0
Complexity:
1760
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
14
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
5
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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