Catalogue Number: BG849
5-Bromo-4-chloro-3-indolyl β-D-cellotrioside
5-Bromo-4-chloro-1H-indol-3-yl O-β-D-glucopyranosyl-(1→4)-O-β-D-glucopyranosyl-(1→4)-β-D-glucopyranoside
Categories
Properties
- CAS Number
- 2596127-35-2
- Molecular Formula
- C26H35BrClNO16
- Molecular Weight
- 732.91
- Chemical Purity
- Min. 95% [1H-NMR]
- Appearance
- White Crystalline Solid
- Melting Point
- 282-284 °C (dec.)
- Solubility
- DMSO, H2O (hot)
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,3R,4S,5S,6R)-2-{(2R,3S,4R,5R,6S)-6-[(2R,3S,4R,5R,6S)-6-(5-Bromo-4-chloro-1H-indol-3-yloxy)-4,5-dihydroxy-2-(hydroxymethyl)tetrahydro-2H-pyran-3-yloxy]-4,5-dihydroxy-2-(hydroxymethyl)tetrahydro-2H-pyran-3-yloxy}-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol
InChI
InChI=1S/C26H35BrClNO16/c27-7-1-2-8-13(14(7)28)9(3-29-8)40-24-20(38)17(35)22(11(5-31)42-24)45-26-21(39)18(36)23(12(6-32)43-26)44-25-19(37)16(34)15(33)10(4-30)41-25/h1-3,10-12,15-26,29-39H,4-6H2/t10-,11-,12-,15-,16+,17-,18-,19-,20-,21-,22-,23-,24-,25+,26+/m1/s1
InChI Key
QVSASVFUUXPLQF-ROYIFEOQSA-N
Smiles
BrC=1C(=C2C(=CNC2=CC1)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)O)O)O)O)Cl