| SpectraBase Compound ID | G8RcGcM6J4c |
|---|---|
| InChI | InChI=1S/C35H62O11/c1-17(2)19(11-14-45-32-30(42)27(39)22(44-6)16-46-32)8-7-18(3)24-28(40)29(41)31-34(24,5)13-10-23-33(4)12-9-20(36)26(38)25(33)21(37)15-35(23,31)43/h17-32,36-43H,7-16H2,1-6H3/t18-,19+,20?,21?,22+,23?,24+,25?,26?,27-,28?,29?,30+,31?,32+,33?,34?,35?/m1/s1 |
| InChIKey | PUVDMMUEGVDVCS-AMPRQKFVSA-N |
| Mol Weight | 658.9 g/mol |
| Molecular Formula | C35H62O11 |
| Exact Mass | 658.429213 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EOh1t8ByxCq |
|---|---|
| Name | CERTONARDOSIDE_I2 |
| Compound Number | 16 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H62O11 |
| InChI | InChI=1S/C35H62O11/c1-17(2)19(11-14-45-32-30(42)27(39)22(44-6)16-46-32)8-7-18(3)24-28(40)29(41)31-34(24,5)13-10-23-33(4)12-9-20(36)26(38)25(33)21(37)15-35(23,31)43/h17-32,36-43H,7-16H2,1-6H3/t18-,19+,20?,21?,22+,23?,24+,25?,26?,27-,28?,29?,30+,31?,32+,33?,34?,35?/m1/s1 |
| InChIKey | PUVDMMUEGVDVCS-AMPRQKFVSA-N |
| Literature Reference Author | W.WANG,J.HONG,C.O.LEE,K.S.IM,J.S.CHOI,J.H.JUNG |
| Literature Reference Citation | J.NAT.PROD.,67,584(2004) |
| Literature Reference DOI | 10.1021/np030427u |
| Molecular Weight | 658.871 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMZ5689 |