Structure via PubChem · Public domain (PubChem)
In the Vinony graph
Vinony's link graph records 11 inbound references to dynemicin A, and connects out to nucleic acid double helix, Japan and India.
Vinony files it under Angucyclines, Cancer treatments and Carboxylic acids.
Vinony links it to 6 Wikipedia language editions.
Chemical data
- Formula
- C30H19NO9
- Molecular weight
- 537.5 g/mol
- IUPAC name
- (2R,4S,5S,8R,11Z,15S)-21,24,28-trihydroxy-7-methoxy-5-methyl-19,26-dioxo-3-oxa-16-azaheptacyclo[15.12.0.02,4.02,8.04,15.018,27.020,25]nonacosa-1(29),6,11,17,20,22,24,27-octaen-9,13-diyne-6-carboxylic acid
- SMILES
- C[C@H]1C(=C([C@H]2C#C/C=C\C#C[C@H]3[C@]14[C@]2(O4)C5=CC(=C6C(=C5N3)C(=O)C7=C(C=CC(=C7C6=O)O)O)O)OC)C(=O)O
- InChIKey
- AFMYMMXSQGUCBK-AKMKHHNQSA-N
- XLogP
- 3.3
- Polar surface area
- 166 Ų
- H-bond donors
- 5
- H-bond acceptors
- 10
- Formal charge
- 0
via PubChem
Drug data · ChEMBL
- Molecule type
- Small molecule
via ChEMBL · EBI
Wikidata facts
- Subclass of
- alkaloid
- Mass
- 537.105981
Show 4 more facts
- chemical formula
- C₃₀H₁₉NO₉
- isomeric SMILES
- C[C@H]1C(=C([C@H]2C#C/C=C\C#C[C@H]3[C@]14[C@]2(O4)C5=CC(=C6C(=C5N3)C(=O)C7=C(C=CC(=C7C6=O)O)O)O)OC)C(=O)O
- canonical SMILES
- CC1C(=C(C2C#CC=CC#CC3C14C2(O4)C5=CC(=C6C(=C5N3)C(=O)C7=C(C=CC(=C7C6=O)O)O)O)OC)C(=O)O
- Commons category
- Dynemicin A
Sources (1)
via Wikidata · CC0
Connections
nucleic acid double helix
Entity
Japan
Country
India
Country
cancer
Entity
deoxyribonucleic acid
Entity
Gujarat
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digital object identifier
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leukemia
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chemical formula
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Princeton University
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ångström
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molar mass
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PubMed
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bibcode
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CAS Registry Number
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thiol
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PubMed Central
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in vitro experiment
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ligand
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