Catalogue Number: CC359
2-β-D-Cellobiosyloxy-1,4-benzoxazin-3-one
HBOA-cel, 2-(4-O-β-D-Glucopyranosyl-β-D-glucopyranosyloxy)-2H-1,4-benzoxazin-3(4H)-one

Categories
Properties
- CAS Number
- N/A
- Molecular Formula
- C20H27NO13
- Molecular Weight
- 489.43
- Chemical Purity
- Min. 95% [HPLC-UVD]
- Appearance
- Off-White Amorphous Solid
- Solubility
- DMSO, MeOH, H2O
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
2-{(2S,3S,4R,5R,6R)-5-[(2S,3S,4S,5R,6R)-3,4,5-Trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yloxy]-3,4-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yloxy}-2,4-dihydro-1,4-benzoxazin-3-one
InChI
InChI=1S/C20H27NO13/c22-5-9-11(24)12(25)14(27)18(31-9)33-16-10(6-23)32-19(15(28)13(16)26)34-20-17(29)21-7-3-1-2-4-8(7)30-20/h1-4,9-16,18-20,22-28H,5-6H2,(H,21,29)/t9-,10-,11+,12+,13-,14+,15+,16+,18+,19+,20?/m1/s1
InChI Key
IPUQBGQXIKJOBP-SIOPWQTESA-N
Smiles
O[C@@H]1[C@@H](O[C@@H]([C@@H]([C@@H]1O)O)CO)O[C@@H]1[C@@H]([C@@H]([C@@H](O[C@@H]1CO)OC1OC2=C(NC1=O)C=CC=C2)O)O