(3E,5R,8S,9S,10S,11S,13S,14S,17S)-3-hydroxyimino-17-[(E)-N-hydroxy-C-methylcarbonimidoyl]-10,11,13-trimethyl-2,4,5,6,7,8,9,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-11-ol

Base Information

• Chemical Name: (3E,5R,8S,9S,10S,11S,13S,14S,17S)-3-hydroxyimino-17-[(E)-N-hydroxy-C-methylcarbonimidoyl]-10,11,13-trimethyl-2,4,5,6,7,8,9,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-11-ol
• CAS No.: 2302-49-0
• Molecular Formula: C22H36 N2 O3
• Molecular Weight: 376.5328
• NSC Number: 70799
• ChEMBL ID: CHEMBL4297010
• Mol file: 2302-49-0.mol

Synonyms:NSC70799;MLS002693696;CHEMBL4297010;NSC-70799

Chemical Property of (3E,5R,8S,9S,10S,11S,13S,14S,17S)-3-hydroxyimino-17-[(E)-N-hydroxy-C-methylcarbonimidoyl]-10,11,13-trimethyl-2,4,5,6,7,8,9,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-11-ol

Chemical Property:

• Vapor Pressure: 3.86E-14mmHg at 25°C
• Boiling Point: 544.8°C at 760 mmHg
• Flash Point: 367.7°C
• Density: 1.31g/cm³
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 376.27259301
• Heavy Atom Count: 27
• Complexity: 677

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=NO)C1CCC2C1(CC(C3C2CCC4C3(CCC(=NO)C4)C)(C)O)C
• Isomeric SMILES: C/C(=N\O)/[C@H]1CC[C@@H]2[C@@]1(C[C@]([C@H]3[C@H]2CC[C@H]4[C@@]3(CC/C(=N\O)/C4)C)(C)O)C

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