Catalogue Number: MD822
Mycophenolic acid O-β-D-glucuronide
Mycophenolic acid phenolic-β-D-glucuronide, 5-[(2E)-5-Carboxy-3-methyl-2-penten-1-yl]-1,3-dihydro-6-methoxy-7-methyl-3-oxo-4-isobenzofuranyl β-D-glucopyranosiduronic acid, MPAG
Categories
Properties
- CAS Number
- 31528-44-6
- Molecular Formula
- C23H28O12
- Molecular Weight
- 496.46
- Chemical Purity
- Min. 95% [HPLC-UVD]
- Appearance
- White Amorphous Solid
- Solubility
- H2O, MeOH
Regulatory
- SDS
- SDS PDF (New Window)
- Search for COA
-
- DSL Status (Canada)
- None
- TSCA Certification (United States)
- Negative Certification
- RTECS Number
- N/A
Storage & Shipping
- Storage
- Store at 0 to -20 °C.
- Shipping Conditions
- Ambient, Express Only
- Tariff Code (United States)
- 2938900000
Safety
- Signal Word
- Warning
- Pictogram
-
- GHS Classification
-
Acute Toxicity, Oral (Category 4)
Germ Cell Mutagenicity (Category 2) - Hazard Statements
-
H302: Harmful if swallowed
H341: Suspected of causing genetic defects - Precautionary Statements
-
P201: Obtain special instructions before use.
P202: Do not handle until all safety precautions have been read and understood.
P264: Wash skin thoroughly after handling.
P281: Use personal protective equipment as required.
P301 + P312 + P330: IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell. Rinse mouth.
P308 + P313: IF exposed or concerned: Get medical advice/attention.
P405: Store locked up.
Search Terms
IUPAC Name
(2S,3S,4S,5R,6S)-6-{6-[(E)-5-Carboxy-3-methyl-2-pentenyl]-5-methoxy-4-methyl-7-phthalideyloxy}-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid
InChI
InChI=1S/C23H28O12/c1-9(5-7-13(24)25)4-6-11-18(32-3)10(2)12-8-33-22(31)14(12)19(11)34-23-17(28)15(26)16(27)20(35-23)21(29)30/h4,15-17,20,23,26-28H,5-8H2,1-3H3,(H,24,25)(H,29,30)/b9-4+/t15-,16-,17+,20-,23+/m0/s1
InChI Key
BYFGTSAYQQIUCN-HGIHDBQLSA-N
Smiles
C(=O)(O)CC/C(=C/CC1=C(C(=C2COC(=O)C2=C1O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)C(=O)O)O)O)O)C)OC)/C