| SpectraBase Spectrum ID |
HBuMjmDBXSf |
| Name |
.beta.-D-Glucopyranose, 3,4-diacetate 1,2,6-tri-1H-pyrrole-2-carboxylate |
| Alternate Name(s) |
.beta.-D-glucopyranose 1,2,6-tri(pyrrole-2-oxycarbonyl)-3,4-diacetate
3,4-Di-O-acetyl-1,2,6-tris-O-(1H-pyrrol-2-ylcarbonyl)-.beta.-D-glucopyranose |
| CAS Registry Number |
95245-59-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H25N3O11 |
| InChI |
InChI=1S/C25H25N3O11/c1-13(29)35-19-18(12-34-22(31)15-6-3-9-26-15)37-25(39-24(33)17-8-5-11-28-17)21(20(19)36-14(2)30)38-23(32)16-7-4-10-27-16/h3-11,18-21,25-28H,12H2,1-2H3/t18-,19-,20+,21-,25+/m1/s1 |
| InChIKey |
MOKHBEOJLKUTBV-LMHDGWJKSA-N |
| Molecular Weight |
543.485 g/mol |
| SMILES |
[nH]1cccc1C(O[C@@]1(O[C@@]([C@]([C@@]([C@]1(OC(c1[nH]ccc1)=O)[H])(OC(=O)C)[H])(OC(=O)C)[H])(COC(c1[nH]ccc1)=O)[H])[H])=O |
| SPLASH |
splash10-0006-9100000000-b07e70c4a5c49dc1d816 |
| Source of Spectrum |
B-38-205-0 |
| Wiley ID |
1404929 |
