| SpectraBase Compound ID | IatYue80B2A |
|---|---|
| InChI | InChI=1S/C27H46O12/c1-12-4-6-15-14(8-27(15,2)3)13(5-7-16(12)29)10-36-25-24(35)22(33)20(31)18(39-25)11-37-26-23(34)21(32)19(30)17(9-28)38-26/h13-26,28-35H,1,4-11H2,2-3H3/t13-,14?,15?,16-,17-,18-,19-,20-,21+,22+,23-,24-,25-,26-/m0/s1 |
| InChIKey | MYYDVMVPCJAUJA-NTERCUKSSA-N |
| Mol Weight | 562.7 g/mol |
| Molecular Formula | C27H46O12 |
| Exact Mass | 562.298927 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9yu4SZKcHMs |
|---|---|
| Name | (1R,5R,8S,9S)-CARYOPHYLLA-4(15)-ENE-5,14-DIOL 14-0-B-D-GLUCOPYRANOSYL-(1-6)-B-D-GLUCOPYRANOSIDE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C27H46O12 |
| InChI | InChI=1S/C27H46O12/c1-12-4-6-15-14(8-27(15,2)3)13(5-7-16(12)29)10-36-25-24(35)22(33)20(31)18(39-25)11-37-26-23(34)21(32)19(30)17(9-28)38-26/h13-26,28-35H,1,4-11H2,2-3H3/t13-,14?,15?,16-,17-,18-,19-,20-,21+,22+,23-,24-,25-,26-/m0/s1 |
| InChIKey | MYYDVMVPCJAUJA-NTERCUKSSA-N |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |