| SpectraBase Compound ID | AihVLSgi2bU |
|---|---|
| InChI | InChI=1S/C35H44O18/c1-15-27(47-16(2)38)29(50-22(40)10-7-18-5-8-19(44-4)9-6-18)30(48-17(3)39)34(46-15)51-28-20-11-12-45-32(23(20)35(14-37)31(28)53-35)52-33-26(43)25(42)24(41)21(13-36)49-33/h5-12,15,20-21,23-34,36-37,41-43H,13-14H2,1-4H3/b10-7+/t15-,20?,21+,23?,24+,25-,26+,27-,28+,29+,30+,31+,32+,33-,34-,35-/m1/s1 |
| InChIKey | RRBUKTFTHGQFCF-QQAWFPOLSA-N |
| Mol Weight | 752.7 g/mol |
| Molecular Formula | C35H44O18 |
| Exact Mass | 752.252765 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6b2f2IzhDKw |
|---|---|
| Name | SCROPOLIOSIDE_A |
| Compound Number | 104 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H44O18 |
| InChI | InChI=1S/C35H44O18/c1-15-27(47-16(2)38)29(50-22(40)10-7-18-5-8-19(44-4)9-6-18)30(48-17(3)39)34(46-15)51-28-20-11-12-45-32(23(20)35(14-37)31(28)53-35)52-33-26(43)25(42)24(41)21(13-36)49-33/h5-12,15,20-21,23-34,36-37,41-43H,13-14H2,1-4H3/b10-7+/t15-,20?,21+,23?,24+,25-,26+,27-,28+,29+,30+,31+,32+,33-,34-,35-/m1/s1 |
| InChIKey | RRBUKTFTHGQFCF-QQAWFPOLSA-N |
| Literature Reference Author | C.A.BOROS,F.R.STERMITZ |
| Literature Reference Citation | J.NAT.PROD.,53,1055(1990) |
| Literature Reference DOI | 10.1021/np50071a001 |
| Molecular Weight | 752.724 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMZ16097 |