Catalogue Number: RD808
Rotigotine O-β-D-glucuronide
(6S)-5,6,7,8-Tetrahydro-6-[propyl[2-(2-thienyl)ethyl]amino]-1-naphthalenyl β-D-glucopyranosiduronic acid
Categories
Properties
- CAS Number
- 128464-29-9
- Molecular Formula
- C25H33NO7S
- Molecular Weight
- 491.60
- Chemical Purity
- Min. 98% [HPLC-UVD]
- Appearance
- White Solid
- Solubility
- DMSO, 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
Not a dangerous substance according to GHS.
Search Terms
IUPAC Name
(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[[(6S)-6-[propyl(2-thiophen-2-ylethyl)amino]-5,6,7,8-tetrahydronaphthalen-1-yl]oxy]oxane-2-carboxylic acid
InChI
InChI=1S/C25H33NO7S/c1-2-11-26(12-10-17-6-4-13-34-17)16-8-9-18-15(14-16)5-3-7-19(18)32-25-22(29)20(27)21(28)23(33-25)24(30)31/h3-7,13,16,20-23,25,27-29H,2,8-12,14H2,1H3,(H,30,31)/t16-,20-,21-,22+,23-,25+/m0/s1
InChI Key
KIZPMKLPMDPLQT-JUHHHSNRSA-N
Smiles
O[C@@H]1[C@H](O[C@H]([C@@H]([C@H]1O)O)OC1=CC=CC=2C[C@H](CCC12)N(CCC=1SC=CC1)CCC)C(=O)O