Glucosyl-glucosyl-glucosyl-asparagine
Basic information
- CAS
77437-53-7- Standard SMILES
NC(CC(=O)NC1OC(COC2OC(COC3OC(CO)C(O)C(O)C3O)C(O)C(O)C2O)C(O)C(O)C1O)C(=O)O- InChIKey
UKXPESZDAOPCJE-QTEFDQIRSA-N- Molecular formula
- C22H38N2O18
- Average molar mass
- 618.5 g/mol
- Monoisotopic mass
- 618.21196237
Names & identifiers
- Preferred name
- Glucosyl-glucosyl-glucosyl-asparagine
- IUPAC
- 2-amino-4-oxo-4-[[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxymethyl]oxan-2-yl]amino]butanoic acid
- English name
- glucosyl-glucosyl-glucosyl-asparagine
- Molecular weight
- 0
Names & synonyms
Glycotriosyl asperagineTriglc-asnGlucosyl-glucosyl-glucosyl-asparagine77437-53-7RefChem:1436422-amino-4-oxo-4-[[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxymethyl]oxan-2-yl]amino]butanoic acidalpha-Glc-(1-6)-beta-glc-(1-6)-alpha-glc-(1-asn)Triglucosyl-asparaginel-asparagine, N2-(O-alpha-D-glucopyranosyl-(1->6)-O-beta-D-glucopyranosyl-(1->6)-alpha-D-glucopyranosyl)-L-Asparagine, N-(O-alpha-D-glucopyranosyl-(1-6)-O-beta-D-glucopyranosyl-(1-6)-alpha-D-glucopyranosyl)-
Database identifiers
- CAS
77437-53-7- PubChem CID
- 173589
Properties
Computed structural properties
- XLogP
- -10
- Topological polar surface area
- 341 Ų
- Hydrogen bond donors
- 13
- Hydrogen bond acceptors
- 19
- Rotatable bonds
- 11
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 901
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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