| SpectraBase Compound ID | 4m6Yo8TnKTh |
|---|---|
| InChI | InChI=1S/C42H68O15/c1-37(2)14-20-19-8-9-23-39(5)12-11-26(38(3,4)22(39)10-13-40(23,6)41(19,7)16-25(46)42(20,18-44)24(45)15-37)55-36-31(51)32(30(50)33(57-36)34(52)53)56-35-29(49)28(48)27(47)21(17-43)54-35/h8,20-33,35-36,43-51H,9-18H2,1-7H3,(H,52,53)/t20-,21+,22-,23+,24-,25-,26-,27+,28-,29+,30-,31+,32-,33-,35-,36+,39-,40+,41+,42+/m0/s1 |
| InChIKey | VTXFLUJNMHWAAT-XVGDWFOMSA-N |
| Mol Weight | 813.0 g/mol |
| Molecular Formula | C42H68O15 |
| Exact Mass | 812.455821 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6fZAZI7VS0I |
|---|---|
| Name | ALTERNOSIDE-VII;CHICHIPEGENIN-3-O-BETA-D-GLUCOPYRANOSYL-(1->3)-BETA-D-GLUCURONOPYRANOSIDE |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H68O15 |
| InChI | InChI=1S/C42H68O15/c1-37(2)14-20-19-8-9-23-39(5)12-11-26(38(3,4)22(39)10-13-40(23,6)41(19,7)16-25(46)42(20,18-44)24(45)15-37)55-36-31(51)32(30(50)33(57-36)34(52)53)56-35-29(49)28(48)27(47)21(17-43)54-35/h8,20-33,35-36,43-51H,9-18H2,1-7H3,(H,52,53)/t20-,21+,22-,23+,24-,25-,26-,27+,28-,29+,30-,31+,32-,33-,35-,36+,39-,40+,41+,42+/m0/s1 |
| InChIKey | VTXFLUJNMHWAAT-XVGDWFOMSA-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 | 812.993 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS6573 |