| SpectraBase Compound ID | IxclXtjjJLE |
|---|---|
| InChI | InChI=1S/C39H66O18/c1-9-39(8,15-11-14-18(4)13-10-12-17(2)3)57-38-34(28(45)25(42)22(54-38)16-50-35-30(47)26(43)23(40)19(5)51-35)56-37-32(49)29(46)33(21(7)53-37)55-36-31(48)27(44)24(41)20(6)52-36/h9,12,14,19-38,40-49H,1,10-11,13,15-16H2,2-8H3/b18-14+/t19-,20-,21+,22+,23-,24-,25+,26+,27+,28-,29+,30+,31+,32-,33+,34+,35+,36-,37+,38-,39?/m1/s1 |
| InChIKey | RTDSIIMUYUALQO-YOACMHFGSA-N |
| Mol Weight | 822.9 g/mol |
| Molecular Formula | C39H66O18 |
| Exact Mass | 822.424915 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1whuto0l2vV |
|---|---|
| Name | NEROLIDOL-3-O-ALPHA-L-RHAMNOPYRANOSYL-(1->4)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-RHAMNOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRANOSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H66O18 |
| InChI | InChI=1S/C39H66O18/c1-9-39(8,15-11-14-18(4)13-10-12-17(2)3)57-38-34(28(45)25(42)22(54-38)16-50-35-30(47)26(43)23(40)19(5)51-35)56-37-32(49)29(46)33(21(7)53-37)55-36-31(48)27(44)24(41)20(6)52-36/h9,12,14,19-38,40-49H,1,10-11,13,15-16H2,2-8H3/b18-14+/t19-,20-,21+,22+,23-,24-,25+,26+,27+,28-,29+,30+,31+,32-,33+,34+,35+,36-,37+,38-,39?/m1/s1 |
| InChIKey | RTDSIIMUYUALQO-YOACMHFGSA-N |
| Literature Reference Author | N.DETOMMASI,F.DESIMONE,R.AQUINO,C.PIZZA,Z.Z.LIANG |
| Literature Reference Citation | J.NAT.PROD.,53,810(1990) |
| Literature Reference DOI | 10.1021/np50070a005 |
| Molecular Weight | 822.942 g/mol |
| Solvent | Unknown |
| Source File Reference | UWED16993 |