CAS: 162635-04-3 - Temsirolimus

Formula: C₅₆H₈₇NO₁₆

InChI: InChI=1/C56H87NO16/c1-33-17-13-12-14-18-34(2)45(68-9)29-41-22-20-39(7)56(67,73-41)51(63)52(64)57-24-16-15-19-42(57)53(65)71-46(30-43(60)35(3)26-38(6)49(62)50(70-11)48(61)37(5)25-33)36(4)27-40-21-23-44(47(28-40)69-10)72-54(66)55(8,31-58)32-59/h12-14,17-18,26,33,35-37,39-42,44-47,49-50,58-59,62,67H,15-16,19-25,27-32H2,1-11H3/b14-12+,17-13+,34-18+,38-26+/t33-,35-,36-,37-,39-,40+,41+,42+,44-,45+,46+,47-,49-,50+,56-/m1/s1

InChI key: InChIKey=CBPNZQVSJQDFBE-FUXHJELOSA-N

SMILES: O=C1OC(CC(=O)C(C=C(C)C(O)C(OC)C(=O)C(C)CC(C=CC=CC=C(C)C(OC)CC2OC(O)(C(=O)C(=O)N3CCCCC13)C(C)CC2)C)C)C(C)CC4CCC(OC(=O)C(C)(CO)CO)C(OC)C4

Synonyms:

• (1R,2R,5S)-5-{(2S)-2-[(3S,6R,7E,9R,10R,12R,14S,15Z,17E,19E,21S,26R,27R,34aS)-9,27-dihydroxy-10,21-dimethoxy-6,8,12,14,20,26-hexamethyl-1,5,11,28,29-pentaoxo-1,4,5,6,9,10,11,12,13,14,21,22,23,24,25,26,27,28,29,31,32,33,34,34a-tetracosahydro-3H-23,27-epoxypyrido[2,1-c][1,4]oxazacyclohentriacontin-3-yl]propyl}-2-methoxycyclohexyl 3-hydroxy-2-(hydroxymethyl)-2-methylpropanoate
• 4-{2-[(7E,15Z,17E,19E)-9,27-dihydroxy-10,21-dimethoxy-6,8,12,14,20,26-hexamethyl-1,5,11,28,29-pentaoxo-1,4,5,6,9,10,11,12,13,14,21,22,23,24,25,26,27,28,29,31,32,33,34,34a-tetracosahydro-3H-23,27-epoxypyrido[2,1-c][1,4]oxazacyclohentriacontin-3-yl]propyl}-2-methoxycyclohexyl 3-hydroxy-2-(hydroxymethyl)-2-methylpropanoate
• 40-[3-Hydroxy-2-(hydroxymethyl)-2-methylpropanoate]-rapamycin
• Cci 779
• Ccl-779
• NSC 683864
• Rapamycin 42-[3-Hydroxy-2-(hydroxymethyl)-2-methylpropanoate
• Temsorolimus
• Torisel
• Way-Cci 779
• Temsirolimus

Temsirolimus

CAS: 162635-04-3

• Formula: C₅₆H₈₇NO₁₆
• Purity: >95.0%(HPLC)
• Color and Shape: White to Almost white powder to crystal
• Molecular weight: 1,030.30

Temsirolimus

CAS: 162635-04-3

• Formula: C₅₆H₈₇NO₁₆
• Purity: 98%
• Color and Shape: Solid
• Molecular weight: 1030.2871

Temsirolimus

CAS: 162635-04-3

• Formula: C₅₆H₈₇NO₁₆
• Molecular weight: 1030.29

Temsirolimus

CAS: 162635-04-3

• Formula: C₅₆H₈₇NO₁₆
• Color and Shape: White To Off-White Solid
• Molecular weight: 1030.30

Temsirolimus

CAS: 162635-04-3

Temsirolimus (CCI-779) is a specific mTOR inhibitor ( IC50: 1.76 μM), used in the treatment …

• Formula: C₅₆H₈₇NO₁₆
• Purity: 100% - 99.64%
• Color and Shape: White Crystalline Powder
• Molecular weight: 1030.29

Temsirolimus (~90%)

CAS: 162635-04-3

Applications Ester analog of Rapamycin. References Raymond, E., et al.: J. Clin. Oncol., 22, 2336 …

• Formula: C₅₆H₈₇NO₁₆
• Purity: >80%
• Color and Shape: Neat
• Molecular weight: 1030.29

Temsirolimus-d3

CAS: 162635-04-3

Applications Labelled ester analog of Rapamycin. References Raymond, E., et al.: J. Clin. Oncol., 22, …

• Formula: C₅₆H₈₄D₃NO₁₆
• Purity: >85%
• Color and Shape: Neat
• Molecular weight: 1033.31

Temsirolimus

CAS: 162635-04-3

mTOR serine/threonine kinase inhibitor

• Formula: C₅₆H₈₇NO₁₆
• Purity: Min. 95%
• Color and Shape: Powder
• Molecular weight: 1,030.29 g/mol

Temsirolimus-13C3,d7

CAS: 162635-04-3

• Formula: C₃C₅₃D₇H₈₀NO₁₆
• Color and Shape: Neat
• Molecular weight: 1040.308