Catalogue Number: ED147L
Ecopipam-d6 O-β-D-glucuronide
11-Chloro-6,6a,7,8,9,13b-hexahydro-7-methyl-5H-benzo[d]naphth[2,1-b]azepin-12-yl-1,2,3,4,10,13-d6 β-D-glucopyranosiduronic acid
Categories
Properties
- CAS Number
- N/A
- Molecular Formula
- C25H22D6ClNO7
- Molecular Weight
- 495.98
- Chemical Purity
- Min. 95% [HPLC-UVD]
- Isotopic Enrichment
- 95 atom % D
- Appearance
- Off-White Solid
- Solubility
- DMSO, MeOH, H2O (weakly)
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 8 °C.
- Shipping Conditions
- Ambient Temperature
- Tariff Code (United States)
- 2938900000
Safety
Not a dangerous substance according to GHS.
Search Terms
IUPAC Name
(2S,3S,4S,5R,6S)-6-{5-Chloro-10-methyl(3,6,15,16,17,18-2H6)-10-azatetracyclo[9.8.0.02,7.014,19]nonadeca-2,4,6,14,16,18-hexaen-4-yloxy}-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid
InChI
InChI=1S/C25H28ClNO7/c1-27-9-8-13-10-16(26)18(33-25-22(30)20(28)21(29)23(34-25)24(31)32)11-15(13)19-14-5-3-2-4-12(14)6-7-17(19)27/h2-5,10-11,17,19-23,25,28-30H,6-9H2,1H3,(H,31,32)/t17?,19?,20-,21-,22+,23-,25+/m0/s1/i2D,3D,4D,5D,10D,11D
InChI Key
SFLVDSOZENBDFN-JUBCQUQJSA-N
Smiles
ClC1=C(C(=C2C3C4=C(C(=C(C(=C4CCC3N(CCC2=C1[2H])C)[2H])[2H])[2H])[2H])[2H])O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)C(=O)O)O)O)O