Actinomycin D, 8-amino-7-hydroxy-
Basic information
- CAS
95045-12-8- Standard SMILES
Cc1c2oc3c(C)c(O)c(N)c(C(=O)NC4C(=O)NC(C(C)C)C(=O)N5CCCC5C(=O)N(C)CC(=O)N(C)C(C(C)C)C(=O)OC4C)c3nc-2c(C(=O)NC2C(=O)NC(C(C)C)C(=O)N3CCCC3C(=O)N(C)CC(=O)N(C)C(C(C)C)C(=O)OC2C)c(N)c1=O- InChIKey
VWOCNFIGQGBJNQ-UHFFFAOYSA-N- Molecular formula
- C62H87N13O17
- Average molar mass
- 1,286.4 g/mol
- Monoisotopic mass
- 1,285.63428836
Names & identifiers
- Preferred name
- Actinomycin D, 8-amino-7-hydroxy-
- IUPAC
- 2,8-diamino-3-hydroxy-4,6-dimethyl-7-oxo-1-N,9-N-bis[7,11,14-trimethyl-2,5,9,12,15-pentaoxo-3,10-di(propan-2-yl)-8-oxa-1,4,11,14-tetrazabicyclo[14.3.0]nonadecan-6-yl]phenoxazine-1,9-dicarboxamide
Names & synonyms
Actinomycin D, 8-amino-7-hydroxy-95045-12-8
Database identifiers
- CAS
95045-12-8- PubChem CID
- 185385
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 402 Ų
- Hydrogen bond donors
- 7
- Hydrogen bond acceptors
- 20
- Rotatable bonds
- 8
- Heavy atoms
- 92
- Formal charge
- 0
- Complexity
- 3,110
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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