| SpectraBase Compound ID | DPPucjbhj0R |
|---|---|
| InChI | InChI=1S/C48H78O20/c1-43(2)14-21-20-8-9-25-45(5)12-11-28(66-42-36(60)37(35(59)38(68-42)39(61)62)67-41-34(58)32(56)30(54)23(18-50)65-41)44(3,4)24(45)10-13-46(25,6)47(20,7)16-27(52)48(21,26(51)15-43)19-63-40-33(57)31(55)29(53)22(17-49)64-40/h8,21-38,40-42,49-60H,9-19H2,1-7H3,(H,61,62)/t21-,22+,23+,24-,25+,26-,27-,28-,29+,30+,31-,32-,33+,34+,35-,36+,37-,38-,40+,41-,42+,45-,46+,47+,48+/m0/s1 |
| InChIKey | KXFVFEKZELMHLD-LWCOWBNSSA-N |
| Mol Weight | 975.1 g/mol |
| Molecular Formula | C48H78O20 |
| Exact Mass | 974.508645 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4gqPD93Yy51 |
|---|---|
| Name | ALTERNOSIDE-VI;CHICHIPEGENIN-3-O-BETA-D-GLUCOPYRANOSYL-(1->3)-BETA-D-GLUCURONOPYRANOSYL-28-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H78O20 |
| InChI | InChI=1S/C48H78O20/c1-43(2)14-21-20-8-9-25-45(5)12-11-28(66-42-36(60)37(35(59)38(68-42)39(61)62)67-41-34(58)32(56)30(54)23(18-50)65-41)44(3,4)24(45)10-13-46(25,6)47(20,7)16-27(52)48(21,26(51)15-43)19-63-40-33(57)31(55)29(53)22(17-49)64-40/h8,21-38,40-42,49-60H,9-19H2,1-7H3,(H,61,62)/t21-,22+,23+,24-,25+,26-,27-,28-,29+,30+,31-,32-,33+,34+,35-,36+,37-,38-,40+,41-,42+,45-,46+,47+,48+/m0/s1 |
| InChIKey | KXFVFEKZELMHLD-LWCOWBNSSA-N |
| Literature Reference Author | K.YOSHIKAWA,H.OGATA,S.ARIHARA,H.C.CHANG,J.D.WANG |
| Literature Reference Citation | CHEM.PHARM.BULL.,46,1102(1998) |
| Literature Reference DOI | 10.1248/cpb.46.1102 |
| Molecular Weight | 975.135 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS6572 |