Paclitaxel Succinate-d4
Product Code
TRC-P132532
Product Format
Neat
Molecular Formula
C₅₁H₅₁D₄NO₁₇
Molecular Weight
958.0
Product Categories
Additional Cancer Bioactive Molecules, TRC, Biomaterials, Additional pharmaceutical toxicology research materials, Stable isotopes
Product Type
Stable Isotope LabelledUnlabelled CAS Number
Price and availability
Product Information
Product Data
Analyte Name
Paclitaxel Succinate-d4
Molecular Formula
C₅₁H₅₁D₄NO₁₇
Molecular Weight
958.0
Accurate Mass
957.37
SMILES
O=C(C)O[C@H](C1=C(C)[C@@H](OC([C@H](OC(C([2H])([2H])C([2H])([2H])C(O)=O)=O)[C@@H](NC(C2=CC=CC=C2)=O)C3=CC=CC=C3)=O)C[C@]([C@@H](OC(C4=CC=CC=C4)=O)[C@@]5([H])[C@@]6(C)[C@@H](O)C[C@@H]7[C@@]5(OC(C)=O)CO7)(O)C1(C)C)C6=O
InChI
InChI=1S/C51H55NO17/c1-27-33(66-47(62)41(67-37(58)23-22-36(56)57)39(30-16-10-7-11-17-30)52-45(60)31-18-12-8-13-19-31)25-51(63)44(68-46(61)32-20-14-9-15-21-32)42-49(6,34(55)24-35-50(42,26-64-35)69-29(3)54)43(59)40(65-28(2)53)38(27)48(51,4)5/h7-21,33-35,39-42,44,55,63H,22-26H2,1-6H3,(H,52,60)(H,56,57)/t33-,34-,35+,39-,40+,41+,42-,44-,49?,50-,51+/m0/s1/i22D2,23D2
IUPAC
4-(((1S,2R)-1-benzamido-3-(((2aR,4S,4aS,6R,9S,11S,12S,12aR,12bS)-6,12b-diacetoxy-12-(benzoyloxy)-4,11-dihydroxy-4a,8,13,13-tetramethyl-5-oxo-2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-1H-7,11-methanocyclodeca[3,4]benzo[1,2-b]oxet-9-yl)oxy)-3-oxo-1-phenylpropan-2-yl)oxy)-4-oxobutanoic-2,2,3,3-d4 acid
Unlabelled CAS Number
117527-50-1
SIL Type
Deuterium
Storage & Transport Information
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Attributes
Product Format
Neat
Related Products
Please login or register to add to your favourites
Or continue browsing without access to favourites or pricing
Please log in to view pricing and add to cart
Or continue browsing to see available rounds without pricing information
If you don't yet have an account, please create an account create an account