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Basic information
- CAS
960210-99-5- Standard SMILES
C/C=C\C[C@@H](C/C=C\NC(=O)[C@@H](NC(=O)\C=C/C=C\C(C)=C\[C@H](C)[C@@H]1CC=C(OC)C(=O)O1)C(C)(C)C)OC(N)=O- InChIKey
IEKGSKLKBICCHQ-BDOJOPHNSA-N- Molecular formula
- C31H45N3O7
- Average molar mass
- 571.7 g/mol
Names & identifiers
- Preferred name
- Plocabulin
- English name
- Plocabulin
- Molecular formula
- C31H45N3O7
- Molecular weight
- 571.7
Names & synonyms
PM060184PM-060184Plocabulin2,4,6-Nonatrienamide, N-[(1S)-1-[[[(1Z,4S,6Z)-4-[(aminocarbonyl)oxy]-1,6-octadien-1-yl]amino]carbonyl]-2,2-dimethylpropyl]-8-[(2S)-3,6-dihydro-5-methoxy-6-oxo-2H-pyran-2-yl]-6-methyl-, (2Z,4Z,6E,8S)-
Database identifiers
- CAS
960210-99-5- PubChem CID
- 57788271
- ChEMBL
CHEMBL4297636- UNII
- 52Y8L60CR7
- Nikkaji
- J3.348.355D
Properties
Physicochemical properties
- Boiling point
- 862.5 · 862.5±65.0 °C(Predicted)
- Density
- 1.13 · 1.13±0.1 g/cm3(Predicted)
- pka
- 12.87 · 12.87±0.46(Predicted)
- FDA UNII
- 52 Y8L60CR7 · 52Y8L60CR7
Chemistry & industry
Suppliers3 total
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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