Analyte Name

Intedanib N-beta-D-Glucuronide

Molecular Formula

C36H39N5O10

Molecular Weight

701.72

Accurate Mass

701.27

SMILES

O=C1NC2=CC(C(OC)=O)=CC=C2/C1=C(C3=CC=CC=C3)/NC4=CC=C(N([C@H]5[C@H](O)[C@@H](O)[C@H](O)[C@@H](C(O)=O)O5)C(CN6CCN(C)CC6)=O)C=C4

InChI

InChI=1S/C36H39N5O10/c1-39-14-16-40(17-15-39)19-26(42)41(34-31(45)29(43)30(44)32(51-34)35(47)48)23-11-9-22(10-12-23)37-28(20-6-4-3-5-7-20)27-24-13-8-21(36(49)50-2)18-25(24)38-33(27)46/h3-13,18,29-32,34,37,43-45H,14-17,19H2,1-2H3,(H,38,46)(H,47,48)/b28-27-/t29-,30-,31+,32?,34+/m0/s1

IUPAC

(2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-(N-(4-((((Z)-6-(methoxycarbonyl)-2-oxoindolin-3-ylidene)(phenyl)methyl)amino)phenyl)-2-(4-methylpiperazin-1-yl)acetamido)tetrahydro-2H-pyran-2-carboxylic acid

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat