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131276-37-4 | Hexadecanamide, 9,10,16-trihydroxy-N-[2-hydroxy-3-(tetradecyloxy)propyl]-
CAS No: 131276-37-4 Catalog No: AG000VUD MDL No:
Product Description
Catalog Number:
AG000VUD
Chemical Name:
Hexadecanamide, 9,10,16-trihydroxy-N-[2-hydroxy-3-(tetradecyloxy)propyl]-
CAS Number:
131276-37-4
Molecular Formula:
C33H67NO6
Molecular Weight:
573.8882
IUPAC Name:
9,10,16-trihydroxy-N-(2-hydroxy-3-tetradecoxypropyl)hexadecanamide
InChI:
InChI=1S/C33H67NO6/c1-2-3-4-5-6-7-8-9-10-11-17-22-27-40-29-30(36)28-34-33(39)25-20-14-12-13-18-23-31(37)32(38)24-19-15-16-21-26-35/h30-32,35-38H,2-29H2,1H3,(H,34,39)
InChI Key:
OCOAAZPOBSWYQB-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCOCC(CNC(=O)CCCCCCCC(C(CCCCCCO)O)O)O
UNII:
NQ0RNU9701
Properties
Complexity:
521
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
573.497g/mol
Formal Charge:
0
Heavy Atom Count:
40
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
573.9g/mol
Monoisotopic Mass:
573.497g/mol
Rotatable Bond Count:
32
Topological Polar Surface Area:
119A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
8.1
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