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Zanosar

C8H15N3O7 — CID 2733335

💊View drug profile → streptozocin

Data last refreshed: (MolForge compound catalog, from PubChem)

IUPAC1-methyl-1-nitroso-3-[(3R,4R,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]urea
SMILESCN(N=O)C(=O)N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O
InChIInChI=1S/C8H15N3O7/c1-11(10-17)8(16)9-4-6(14)5(13)3(2-12)18-7(4)15/h3-7,12-15H,2H2,1H3,(H,9,16)/t3-,4-,5-,6-,7?/m1/s1
InChIKeyZSJLQEPLLKMAKR-YDEIVXIUSA-N
MW265.22 g/mol
LogP-2.89
Rot. Bonds3

About Zanosar

Zanosar (PubChem CID 2733335) has the molecular formula C8H15N3O7 and a molecular weight of 265.22 g/mol. Its IUPAC name is 1-methyl-1-nitroso-3-[(3R,4R,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]urea.

Molecular Properties

Compound NameZanosar
PubChem CID2733335
Molecular FormulaC8H15N3O7
Molecular Weight265.22 g/mol
Exact Mass265.09
IUPAC Name1-methyl-1-nitroso-3-[(3R,4R,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]urea
SMILESCN(N=O)C(=O)N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O
InChIInChI=1S/C8H15N3O7/c1-11(10-17)8(16)9-4-6(14)5(13)3(2-12)18-7(4)15/h3-7,12-15H,2H2,1H3,(H,9,16)/t3-,4-,5-,6-,7?/m1/s1
InChIKeyZSJLQEPLLKMAKR-YDEIVXIUSA-N
XLogP-2.89
TPSA151.92 Ų
H-Bond Donors5
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.22
LogP ≤ 5-2.89
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-nitroso', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of Zanosar?
The IUPAC name of Zanosar (CID 2733335) is 1-methyl-1-nitroso-3-[(3R,4R,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]urea.
What is the SMILES notation for Zanosar?
The canonical SMILES for Zanosar is CN(N=O)C(=O)N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O.
What is the InChIKey of Zanosar?
The InChIKey is ZSJLQEPLLKMAKR-YDEIVXIUSA-N. The full InChI is InChI=1S/C8H15N3O7/c1-11(10-17)8(16)9-4-6(14)5(13)3(2-12)18-7(4)15/h3-7,12-15H,2H2,1H3,(H,9,16)/t3-,4-,5-,6-,7?/m1/s1.
What are the key properties of Zanosar?
Zanosar has a molecular weight of 265.22 g/mol, XLogP of -2.89, 3 rotatable bonds, 5 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for Zanosar is sourced from PubChem (CID 2733335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

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