AC1L53FR structure

AC1L53FR

(2R,3R,4S,5S,6R)-2-[(2R,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol;formaldehyde;1,3,5-triazine-2,4,6-triamine

Also Known As: Formalin, melamine, sucrose polymer|KST-1A4192|Melamine, formaldehyde, sucrose polymer|(C12-H22-O11.C3-H6-N6.C-H2-O)x-|1,3,5-Triazine-2,4,6-triamine, polymer with formaldehyde and sucrose|(2r,3r,4s,5s,6r)-2-[(2r,3s,4s,5r)-3,4-dihydroxy-2,5-bis(hydroxymethyl)tetrahydrofuran-2-yl]oxy-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol; formaldehyde; 1,3,5-triazine-2,4,6-triamine|(2R,3R,4S,5S,6R)-2-[(2R,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol; formaldehyde; 1,3,5-triazine-2,4,6-triamine|.alpha.-D-Glucopyranoside, .beta.-D-fructofuranosyl, polymer with formaldehyde and 1,3,5-triazine-2,4,6-triamine|alpha-D-Glucopyranoside, beta-D-fructofuranosyl, polymer with formaldehyde and 1,3,5-triazine-2,4,6-triamine

CAS: 35929-79-4
Molecular Formula C16H30N6O12
Molecular Weight 498.19217 g/mol
LogP -6.9623
Topological Polar Surface Area 323.0 Ų
Hydrogen Bond Donors 11
Hydrogen Bond Acceptors 18
Rotatable Bonds 5
Exact Mass 498.19217
Monoisotopic Mass 498.19217
Heavy Atoms 34
Complexity 460.0

Chemical Identifiers

CAS Number 35929-79-4
SMILES C=O.C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@]2([C@H]([C@@H]([C@H](O2)CO)O)O)CO)O)O)O)O.C1(=NC(=NC(=N1)N)N)N
InChIKey AEOVYGMRCHELJT-JAGAKDGPSA-N

Product Overview

AC1L53FR (CAS 35929-79-4), with molecular formula C16H30N6O12 and molecular weight 498.19217 g/mol. IUPAC: (2R,3R,4S,5S,6R)-2-[(2R,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol;formaldehyde;1,3,5-triazine-2,4,6-triamine.

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