EINECS 234-260-3

2-amino-2-[(2R,3S,5S,6R)-5-amino-2-methyl-6-[(2R,3S,5S,6S)-2,3,4,5,6-pentahydroxycyclohexyl]oxyoxan-3-yl]iminoacetic acid

CAS: 6980-18-3

Molecular Formula	`C14H25N3O9`
Molecular Weight	379.36 g/mol
LogP	-6.7
Topological Polar Surface Area	221.0 A2
Hydrogen Bond Donors	8
Hydrogen Bond Acceptors	11
Rotatable Bonds	4
Exact Mass	379.1591
Heavy Atoms	26
Complexity	532.0

Chemical Identifiers

CAS Number	6980-18-3
SMILES	`CC1C(CC(C(O1)OC2C(C(C(C(C2O)O)O)O)O)N)N=C(C(=O)O)N`
InChIKey	`PVTHJAPFENJVNC-UQTMRZPGSA-N`

📖 Product Overview

EINECS 234-260-3 (CAS: 6980-18-3) is a chemical compound with molecular formula C14H25N3O9 and molecular weight 379.36 g/mol. Its IUPAC systematic name is 2-amino-2-[(2R,3S,5S,6R)-5-amino-2-methyl-6-[(2R,3S,5S,6S)-2,3,4,5,6-pentahydroxycyclohexyl]oxyoxan-3-yl]iminoacetic acid. LogP -6.7 Topological Polar Surface Area 221.0 A2 Hydrogen Bond Donors 8 Hydrogen Bond Acceptors 11 Rotatable Bonds 4 Exact Mass 379.1591 Heavy Atoms 26 Complexity 532.0 InChI Key: PVTHJAPFENJVNC-UQTMRZPGSA-N. SMILES: CC1C(CC(C(O1)OC2C(C(C(C(C2O)O)O)O)O)N)N=C(C(=O)O)N.

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