![CMPD-#4;DERRISCANDENOSIDE-D-HEXAACETATE;AFROMOSIN-7-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->6)]-BETA-D-GLUCOPYRANOSIDE-HEXAACETATE;6,4-DIMETHOXY-7-O-[ALPHA-L-RHAMNOPYRA](/api/spectrum/3HkLJOlpsej/structure.png?h=300&w=458 "CMPD-#4;DERRISCANDENOSIDE-D-HEXAACETATE;AFROMOSIN-7-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->6)]-BETA-D-GLUCOPYRANOSIDE-HEXAACETATE;6,4-DIMETHOXY-7-O-[ALPHA-L-RHAMNOPYRA")
| SpectraBase Compound ID | 3rJgl9txPc8 |
|---|---|
| InChI | InChI=1S/C41H46O20/c1-18-34(54-19(2)42)36(56-21(4)44)38(58-23(6)46)40(53-18)52-17-32-35(55-20(3)43)37(57-22(5)45)39(59-24(7)47)41(61-32)60-31-15-29-27(14-30(31)50-9)33(48)28(16-51-29)25-10-12-26(49-8)13-11-25/h10-16,18,32,34-41H,17H2,1-9H3/t18-,32-,34-,35-,36+,37+,38+,39-,40+,41-/m1/s1 |
| InChIKey | ZQCVFTBCAMXJHD-JLVZTXDXSA-N |
| Mol Weight | 858.8 g/mol |
| Molecular Formula | C41H46O20 |
| Exact Mass | 858.258244 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3HkLJOlpsej |
|---|---|
| Name | CMPD-#4;DERRISCANDENOSIDE-D-HEXAACETATE;AFROMOSIN-7-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->6)]-BETA-D-GLUCOPYRANOSIDE-HEXAACETATE;6,4-DIMETHOXY-7-O-[ALPHA-L-RHAMNOPYRA |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H46O20 |
| InChI | InChI=1S/C41H46O20/c1-18-34(54-19(2)42)36(56-21(4)44)38(58-23(6)46)40(53-18)52-17-32-35(55-20(3)43)37(57-22(5)45)39(59-24(7)47)41(61-32)60-31-15-29-27(14-30(31)50-9)33(48)28(16-51-29)25-10-12-26(49-8)13-11-25/h10-16,18,32,34-41H,17H2,1-9H3/t18-,32-,34-,35-,36+,37+,38+,39-,40+,41-/m1/s1 |
| InChIKey | ZQCVFTBCAMXJHD-JLVZTXDXSA-N |
| Literature Reference Author | V.RUKACHAISIRIKUL,Y.SUKPONDMA,C.JANSAKUL,W.C.TAYLOR |
| Literature Reference Citation | PHYTOCHEM.,60,827(2002) |
| Literature Reference DOI | 10.1016/S0031-9422(02)00163-2 |
| Molecular Weight | 858.804 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS1846 |