| SpectraBase Compound ID | 1Jft9004sAE |
|---|---|
| InChI | InChI=1S/C27H42O15/c1-11(2)5-17(31)41-25-18-12(6-28)3-4-14(18)13(9-37-25)10-38-26-23(36)21(34)24(16(8-30)40-26)42-27-22(35)20(33)19(32)15(7-29)39-27/h3,9,11,14-16,18-30,32-36H,4-8,10H2,1-2H3/t14?,15-,16+,18?,19-,20+,21+,22-,23+,24+,25+,26+,27+/m1/s1 |
| InChIKey | NPCCFNTZZXOWME-HQCDTHMRSA-N |
| Mol Weight | 606.6 g/mol |
| Molecular Formula | C27H42O15 |
| Exact Mass | 606.252371 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I8Rbtjv1PFV |
|---|---|
| Name | PENSTEBIOSIDE |
| Compound Number | 14 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H42O15 |
| InChI | InChI=1S/C27H42O15/c1-11(2)5-17(31)41-25-18-12(6-28)3-4-14(18)13(9-37-25)10-38-26-23(36)21(34)24(16(8-30)40-26)42-27-22(35)20(33)19(32)15(7-29)39-27/h3,9,11,14-16,18-30,32-36H,4-8,10H2,1-2H3/t14?,15-,16+,18?,19-,20+,21+,22-,23+,24+,25+,26+,27+/m1/s1 |
| InChIKey | NPCCFNTZZXOWME-HQCDTHMRSA-N |
| Literature Reference Author | C.A.BOROS,F.R.STERMITZ |
| Literature Reference Citation | J.NAT.PROD.,54,1173(1991) |
| Literature Reference DOI | 10.1021/np50077a001 |
| Molecular Weight | 606.621 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWCS4396 |