3-methoxy-2-methyl-4-(methylamino)-29-oxa-1,7,17-triazaoctacyclo[12.12.2.1^{2,6}.0^{7,28}.0^{8,13}.0^{15,19}.0^{20,27}.0^{21,26}]nonacosa-8,10,12,14,19,21,23,25,27-nonaen-16-one

• ChemBase ID: 105570
• Molecular Formular: C28H26N4O3
• Molecular Mass: 466.53104
• Monoisotopic Mass: 466.20049071
• SMILES: CNC1CC2OC(C)(C1OC)n1c3c(cccc3)c3c1c1c(c4c(cccc4)n21)c1c3CNC1=O
• Canonical SMILES: CNC1CC2OC(C1OC)(C)n1c3ccccc3c3c1c1n2c2ccccc2c1c1c3CNC1=O
• InChI: InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)
• InChIKey: HKSZLNNOFSGOKW-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 3-methoxy-2-methyl-4-(methylamino)-29-oxa-1,7,17-triazaoctacyclo[12.12.2.1^{2,6}.0^{7,28}.0^{8,13}.0^{15,19}.0^{20,27}.0^{21,26}]nonacosa-8,10,12,14,19,21,23,25,27-nonaen-16-one
• IUPAC Traditional name: staurosporine
• Synonyms: Staurosporin; Antibiotic AM-2282; STAUROSPORINE

Database IDs

• CAS Number: 62996-74-1
• PubChem SID: 162092531
• PubChem CID: 5279

CALCULATED PROPERTIES

• Acid pKa: 14.1448145
• H Acceptors: 4
• H Donor: 2
• LogD (pH = 5.5): 0.7899369
• LogD (pH = 7.4): 1.847076
• Log P: 3.9696732
• Molar Refractivity: 132.3721 cm^3
• Polarizability: 55.985493 Å^3
• Polar Surface Area: 69.45 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Storage Condition: 2-8°C, Protect from light
• European Hazard Symbols: Irritant (Xi)
• Risk Statements: R:36/37/38
• Safety Statements: S:20-25-26-37/39

Product Information

• Purity: ≥98%

DETAILS

MP Biomedicals - 02194805

From Streptomyces sp.
Molecular Biology Reagent
Purity: >98%
Inhibitor of phospholipid/Ca^2+ dependent and cyclic nucleotide dependent protein kinases. A potent protein kinase C inhibitor and useful as a tool for studies on protein phosphorylation in the regulation of cellular functions.

MP Biomedicals - 02191400

From Streptomyces sp. Found to inhibit phospolipid/Ca^2+ dependent and cyclic nucleotide dependent protein kinases. A potent protein kinase inhibitor useful as a tool for studies on protein phosphorylation in the regulation of cellular functions.