Daunorubicin

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 560
Total Number of Articles : 1013
PubChem 30323
Molecular Formula

C27H29NO10

SMILES

C[C@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(=O)C)O)N)O

InChI

InChI=1S/C27H29NO10/c1-10-22(30)14(28)7-17(37-10)38-16-9-27(35,11(2)29)8-13-19(16)26(34)21-20(24(13)32)23(31)12-5-4-6-15(36-3)18(12)25(21)33/h4-6,10,14,16-17,22,30,32,34-35H,7-9,28H2,1-3H3/t10-,14-,16-,17-,22+,27-/m0/s1

synonyms
  • daunorubicin
  • Daunomycin
  • 20830-81-3
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Properties
Property Value
MW 527.5 g/mol
HBD 5
HBA 11
Rotatable Bond Count 4
Exact Mass 527.17914612 g/mol
Monoisotopic Mass 527.17914612 g/mol
Heavy Atom Count 38
Isotope Atom Count 0
Atom Stereo Count 6
Covalent Unit Count 1
Complexity 960
xlogp 1.8
Topological Polar Surface Area 186