Ingenol 3,20-Dibenzoate
Product Code
TRC-I655833-100MG
CAS Number
Product Format
Neat
Molecular Formula
C34 H36 O7
Molecular Weight
556.64
Product Information
Chemical Data
Analyte Name
Ingenol 3,20-Dibenzoate
CAS Number
59086-90-7
Molecular Formula
C34 H36 O7
Molecular Weight
556.64
Accurate Mass
556.2461
SMILES
C[C@@H]1C[C@@H]2[C@H]([C@@H]3C=C(COC(=O)c4ccccc4)[C@@H](O)[C@]5(O)[C@@H](OC(=O)c6ccccc6)C(=C[C@@]15C3=O)C)C2(C)C
InChI
InChI=1S/C34H36O7/c1-19-17-33-20(2)15-25-26(32(25,3)4)24(28(33)36)16-23(18-40-30(37)21-11-7-5-8-12-21)27(35)34(33,39)29(19)41-31(38)22-13-9-6-10-14-22/h5-14,16-17,20,24-27,29,35,39H,15,18H2,1-4H3/t20-,24+,25-,26+,27-,29+,33+,34+/m1/s1
Product Data
Country of Origin
CANADA
Product Format
Neat
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