4-Formyl-2-methoxyphenyl β-D-Glucopyranosiduronic Acid Triacetate Methyl Ester - CAS 704885-44-9
Catalog: |
BB064576 |
Product Name: |
4-Formyl-2-methoxyphenyl β-D-Glucopyranosiduronic Acid Triacetate Methyl Ester |
CAS: |
704885-44-9 |
Synonyms: |
4-Formyl-2-methoxyphenyl |A-D-Glucopyranosiduronic Acid Triacetate Methyl Ester; methyl (2S,3S,4S,5R,6S)-3,4,5-triacetyloxy-6-(4-formyl-2-methoxyphenoxy)oxane-2-carboxylate; 4-FORMYL-2-METHOXYPHENYL BETA-D-GLUCOPYRANOSIDURONIC ACID TRIACETATE METHYL ESTER; 4-Formyl-2-methoxyphenyl methyl 2,3,4-tri-O-acetyl-beta-D-glucopyranosiduronate |
IUPAC Name: | methyl (2S,3S,4S,5R,6S)-3,4,5-triacetyloxy-6-(4-formyl-2-methoxyphenoxy)oxane-2-carboxylate |
Description: | Used in the preparation of epothilone-saccharide conjugates for the treatment of proliferative diseases. |
Molecular Weight: | 468.41 |
Molecular Formula: | C21H24O12 |
Canonical SMILES: | CC(=O)OC1C(C(OC(C1OC(=O)C)OC2=C(C=C(C=C2)C=O)OC)C(=O)OC)OC(=O)C |
InChI: | InChI=1S/C21H24O12/c1-10(23)29-16-17(30-11(2)24)19(31-12(3)25)21(33-18(16)20(26)28-5)32-14-7-6-13(9-22)8-15(14)27-4/h6-9,16-19,21H,1-5H3/t16-,17-,18-,19+,21+/m0/s1 |
InChI Key: | QTHPZBHVIGLWPP-VDRZXAFZSA-N |
Solubility: | Acetone, Chloroform, Dichloromethane, Dimethyl Formamide, Ethyl Acetate, Methano |
Appearance: | Off-White Solid |
Complexity: | 737 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 5 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 468.1267762 |
Formal Charge: | 0 |
Heavy Atom Count: | 33 |
Hydrogen Bond Acceptor Count: | 12 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 468.1267762 |
Rotatable Bond Count: | 12 |
Topological Polar Surface Area: | 150Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Other Building Blocks
Customers Also Viewed
-
[30360-19-1]
N,N'-Diethyl-N''-isopropyl-1,3,5-triazine-2,4,6-triamine
-
[1118-71-4]
2,2,6,6-Tetramethyl-3,5-heptanedione
-
[1184173-73-6]
MK-8353
-
[1643-20-5]
N,N-dimethyldodecan-1-amine oxide
-
[1984-15-2]
Methylenediphosphonic acid
-
[16208-48-3]
Ethanesulfonic acid, 2,2'-trithiodi-, disodium salt
INDUSTRY LEADERS TRUST OUR PRODUCTS