CID 5359307 - PubChem

Compound Summary (CID 5359307)

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Compound Information

Properties and Descriptors

Old Version Substance Information

2D Structure
3D Conformer

Compound Information

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CID 5359307

Create Date: 2005-08-08

Suppressed Compound

Properties and Descriptors

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Properties
Molecular Weight		402.50646 [g/mol]
Molecular Formula		C₁₇H₁₉KN₂O₅S
H-Bond Donor		1
H-Bond Acceptor		6
Rotatable Bond Count		4

Exact Mass		402.065174
MonoIsotopic Mass		402.065174
Topological Polar Surface Area		124
Heavy Atom Count		26
Formal Charge		0
Complexity		570
Isotope Atom Count		0
Defined Atom Stereocenter Count		4
Undefined Atom Stereocenter Count		0
Defined Bond Stereocenter Count		0
Undefined Bond Stereocenter Count		0
Covalently-Bonded Unit Count		2

Descriptors
IUPAC Name
Canonical SMILES
Isomeric SMILES

Old Version Substance Information

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SID 151761, Version: 2, Same
SID 8156080, Version: 1, Same