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Sangivamycin, 6-amino-

HCID 301110
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Basic information

CAS
57071-59-7
Standard SMILES
NC(=O)c1c(N)n(C2OC(CO)C(O)C2O)c2ncnc(N)c12
InChIKey
HRHNKFTXLIBQPZ-UHFFFAOYSA-N
Molecular formula
C12H16N6O5
Average molar mass
324.29 g/mol
Monoisotopic mass
324.11821763

Names & identifiers

Preferred name
Sangivamycin, 6-amino-
IUPAC
4,6-diamino-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidine-5-carboxamide

Names & synonyms

57071-59-7Sangivamycin, 6-amino-NSC177367DTXSID20306531NSC-177367DS-0060084,6-diamino-7-pentofuranosyl-7H-pyrrolo[2,3-d]pyrimidine-5-carboxamide7H-Pyrrolo[2,3-d]pyrimidine-5-carboxamide, 4,6-diamino-7-.beta.-D-ribofuranosyl-

Database identifiers

CAS
57071-59-7
PubChem CID
301110
DTXSID
DTXSID20306531

Properties

Computed structural properties

XLogP
-2.3
Topological polar surface area
196 Ų
Hydrogen bond donors
6
Hydrogen bond acceptors
9
Rotatable bonds
3
Heavy atoms
23
Formal charge
0
Complexity
469

Related reactions

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Compound notes

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