Spiro[2,26-dioxabicyclo[23.3.1]nonacosa-4,18,20-triene-27,2'-[2H]pyran]-3,9,13-trione,22-ethyl-3',4',5',6'-tetrahydro-7,11,14,15-tetrahydroxy-6'-[(2R)-2-hydroxypropyl]-5',6,8,10,12,14,16,29-octamethyl-,(1S,4E,5'S,6S,6'S,7S,8S,10R,11R,12S,14R,15S,16R,18E,20E,22R,25S,27R,29R)-


Chemical Name: Spiro[2,26-dioxabicyclo[23.3.1]nonacosa-4,18,20-triene-27,2'-[2H]pyran]-3,9,13-trione,22-ethyl-3',4',5',6'-tetrahydro-7,11,14,15-tetrahydroxy-6'-[(2R)-2-hydroxypropyl]-5',6,8,10,12,14,16,29-octamethyl-,(1S,4E,5'S,6S,6'S,7S,8S,10R,11R,12S,14R,15S,16R,18E,20E,22R,25S,27R,29R)-
CAS Number: 1404-59-7
Product Number: AG009X9T(AGN-PC-0PPNAN)
Synonyms:
MDL No:
Molecular Formula: C44H72O11
Molecular Weight: 777.0359

Identification/Properties


Computed Properties
Molecular Weight:
777.049g/mol
XLogP3:
6.6
Hydrogen Bond Donor Count:
5
Hydrogen Bond Acceptor Count:
11
Rotatable Bond Count:
3
Exact Mass:
776.507g/mol
Monoisotopic Mass:
776.507g/mol
Topological Polar Surface Area:
180A^2
Heavy Atom Count:
55
Formal Charge:
0
Complexity:
1360
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
17
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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