| SpectraBase Compound ID | KW8RQrQtXtK |
|---|---|
| InChI | InChI=1S/C85H98N4O23/c1-52(2)103-83-76(112-84(93)85(4,5)6)70(100-48-58-38-24-13-25-39-58)72(74(111-83)78(92)95-8)109-81-64(88-89-86)68(98-46-56-34-20-11-21-35-56)65(61(104-81)50-96-44-54-30-16-9-17-31-54)107-82-75(101-49-59-40-26-14-27-41-59)69(99-47-57-36-22-12-23-37-57)71(73(110-82)77(91)94-7)108-80-63(87-53(3)90)67(97-45-55-32-18-10-19-33-55)66-62(105-80)51-102-79(106-66)60-42-28-15-29-43-60/h9-43,52,61-76,79-83H,44-51H2,1-8H3,(H,87,90)/t61-,62+,63+,64+,65+,66+,67+,68+,69-,70-,71-,72-,73+,74+,75+,76+,79+,80+,81+,82+,83+/m1/s1 |
| InChIKey | JZPXTPRSUGQTAU-ZLZHJTDOSA-N |
| Mol Weight | 1543.7 g/mol |
| Molecular Formula | C85H98N4O23 |
| Exact Mass | 1542.662185 g/mol |
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| SpectraBase Spectrum ID | 7NcasuH6tOC |
|---|---|
| Name | #21;METHYL-[ISOPROPYL-O-(2-ACETAMIDO-3-O-BENZYL-4,6-O-BENZYLIDENE-2-DEOXY-ALPHA-D-GLUCOPYRANOSYL-(1->4)-O-(METHYL-2,3-DI-O-BENZYL-ALPHA-L-IDOPYRANOSYLURONATE-( |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C85H98N4O23 |
| InChI | InChI=1S/C85H98N4O23/c1-52(2)103-83-76(112-84(93)85(4,5)6)70(100-48-58-38-24-13-25-39-58)72(74(111-83)78(92)95-8)109-81-64(88-89-86)68(98-46-56-34-20-11-21-35-56)65(61(104-81)50-96-44-54-30-16-9-17-31-54)107-82-75(101-49-59-40-26-14-27-41-59)69(99-47-57-36-22-12-23-37-57)71(73(110-82)77(91)94-7)108-80-63(87-53(3)90)67(97-45-55-32-18-10-19-33-55)66-62(105-80)51-102-79(106-66)60-42-28-15-29-43-60/h9-43,52,61-76,79-83H,44-51H2,1-8H3,(H,87,90)/t61-,62+,63+,64+,65+,66+,67+,68+,69-,70-,71-,72-,73+,74+,75+,76+,79+,80+,81+,82+,83+/m1/s1 |
| InChIKey | JZPXTPRSUGQTAU-ZLZHJTDOSA-N |
| Literature Reference Author | R.OJEDA,J.ANGULO,P.M.NIETO,M.MARTIN-LOMAS |
| Literature Reference Citation | CAN.J.CHEM.,80,917(2002) |
| Literature Reference DOI | 10.1139/v02-023 |
| Molecular Weight | 1543.726 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU29958 |