Molecular properties
- Formula
- C26H27NO9
- Molar mass
- 497.50 g·mol−1
- Exact mass
- 497.1686 Da
- 14
- PubChem CID
- 42890
Molecule record
(7S,9S)-9-acetyl-7-[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-8,10-dihydro-7H-tetracene-5,12-dione
C26H27NO9
497.50 g/mol
Loading structure
Functional groups
Alcohol
Alkane / alkyl carbon
Aromatic ring
Ether
Ketone
Phenol
Primary amine
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 4-DMDR
- 4-Demethoxydaunomycin
- 4-Demethoxydaunorubicin
- 4-Desmethoxydaunorubicin
- 58957-92-9
- CHEBI:42068
- DM5
- DTXCID503142
Show all 24 synonyms
- DTXSID7023142
- Daunomycin, 4-demethoxy-
- IDARUBICIN
- Idarubicin (INN)
- Idarubicin [INN:BAN]
- Idarubicina
- Idarubicina [INN-Spanish]
- Idarubicine
- Idarubicine [INN-French]
- Idarubicinum
- Idarubicinum [INN-Latin]
- L01DB06
- NSC 256439
- RefChem:56926
- ZRP63D75JW
- Zavedos
Structure identifiers
- Canonical SMILES
- CC(=O)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@@H](O[C@H]2C[C@H](N)[C@H](O)[C@H](C)O2)C1)C(=O)c1ccccc1C3=O
- Isomeric 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=CC=CC=C5C4=O)O)(C(=O)C)O)N)O
- InChI
- InChI=1S/C26H27NO9/c1-10-21(29)15(27)7-17(35-10)36-16-9-26(34,11(2)28)8-14-18(16)25(33)20-19(24(14)32)22(30)12-5-3-4-6-13(12)23(20)31/h3-6,10,15-17,21,29,32-34H,7-9,27H2,1-2H3/t10-,15-,16-,17-,21+,26-/m0/s1
- InChIKey
- XDXDZDZNSLXDNA-TZNDIEGXSA-N
- PubChem CID
- 42890
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for (7S,9S)-9-acetyl-7-[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-8,10-dihydro-7H-tetracene-5,12-dione; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for (7S,9S)-9-acetyl-7-[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-8,10-dihydro-7H-tetracene-5,12-dione; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.