| SpectraBase Compound ID | 6sM0S9lkw7l |
|---|---|
| InChI | InChI=1S/C32H54O11/c1-8-30(5,43-29-27(39)25(37)23(35)19(15-33)41-29)12-13-31(6)17(3)14-21(32(7)16(2)10-9-11-20(31)32)42-28-26(38)24(36)22(34)18(4)40-28/h8,10,17-29,33-39H,1,9,11-15H2,2-7H3/t17-,18+,19+,20-,21+,22+,23+,24-,25-,26+,27+,28-,29-,30+,31+,32+/m1/s1 |
| InChIKey | NKUSCFBCYWYMJG-GRQNWGSJSA-N |
| Mol Weight | 614.8 g/mol |
| Molecular Formula | C32H54O11 |
| Exact Mass | 614.366613 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9MRPn3uCNHU |
|---|---|
| Name | 3,14-CLERODADIEN_6-ALPHA-O-BETA-D-QUINOVOPYRANOSYL-13-ALPHA-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H54O11 |
| InChI | InChI=1S/C32H54O11/c1-8-30(5,43-29-27(39)25(37)23(35)19(15-33)41-29)12-13-31(6)17(3)14-21(32(7)16(2)10-9-11-20(31)32)42-28-26(38)24(36)22(34)18(4)40-28/h8,10,17-29,33-39H,1,9,11-15H2,2-7H3/t17-,18+,19+,20-,21+,22+,23+,24-,25-,26+,27+,28-,29-,30+,31+,32+/m1/s1 |
| InChIKey | NKUSCFBCYWYMJG-GRQNWGSJSA-N |
| Literature Reference Author | C.SOCOLSKY,Y.ASAKAWA,A.BARDON |
| Literature Reference Citation | J.NAT.PROD.,70,1837(2007) |
| Literature Reference DOI | 10.1021/np070119m |
| Molecular Weight | 614.774 g/mol |
| Sample ID | 31121 |
| Solvent | CD3OD |