| SpectraBase Compound ID | Jrztep3PRdM |
|---|---|
| InChI | InChI=1S/C27H32O13/c1-35-15-6-3-13(4-7-15)5-8-19(30)38-17-9-14(10-28)20-21(17)16(25(34)36-2)12-37-26(20)40-27-24(33)23(32)22(31)18(11-29)39-27/h3-9,12,17-18,20-24,26-29,31-33H,10-11H2,1-2H3/b8-5+/t17-,18+,20-,21+,22+,23-,24+,26+,27-/m0/s1 |
| InChIKey | VBHBNHXZBKWQNO-HXYUFKHWSA-N |
| Mol Weight | 564.5 g/mol |
| Molecular Formula | C27H32O13 |
| Exact Mass | 564.184291 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9LeFbcmiRuu |
|---|---|
| Name | 6-O-PARA-METHOXYCINNAMOYL-SCANDOSIDE_METHYLESTER |
| Compound Number | 267 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H32O13 |
| InChI | InChI=1S/C27H32O13/c1-35-15-6-3-13(4-7-15)5-8-19(30)38-17-9-14(10-28)20-21(17)16(25(34)36-2)12-37-26(20)40-27-24(33)23(32)22(31)18(11-29)39-27/h3-9,12,17-18,20-24,26-29,31-33H,10-11H2,1-2H3/b8-5+/t17-,18+,20-,21+,22+,23-,24+,26+,27-/m0/s1 |
| InChIKey | VBHBNHXZBKWQNO-HXYUFKHWSA-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 | 564.543 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWMZ16235 |