| SpectraBase Compound ID | 43B4ZS0VZgI |
|---|---|
| InChI | InChI=1S/C35H62O10/c1-18(2)20(11-14-44-32-30(41)27(38)24(43-6)17-45-32)8-7-19(3)26-28(39)29(40)31-34(26,5)13-10-25-33(4)12-9-21(36)15-22(33)23(37)16-35(25,31)42/h18-32,36-42H,7-17H2,1-6H3/t19-,20+,21?,22?,23?,24+,25?,26+,27-,28?,29?,30+,31?,32+,33?,34?,35?/m1/s1 |
| InChIKey | NRTSAVOORBOQBR-BZEJJQKWSA-N |
| Mol Weight | 642.9 g/mol |
| Molecular Formula | C35H62O10 |
| Exact Mass | 642.434298 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EU13PTzeeNs |
|---|---|
| Name | CERTONARDOSIDE_P1 |
| Compound Number | 13 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H62O10 |
| InChI | InChI=1S/C35H62O10/c1-18(2)20(11-14-44-32-30(41)27(38)24(43-6)17-45-32)8-7-19(3)26-28(39)29(40)31-34(26,5)13-10-25-33(4)12-9-21(36)15-22(33)23(37)16-35(25,31)42/h18-32,36-42H,7-17H2,1-6H3/t19-,20+,21?,22?,23?,24+,25?,26+,27-,28?,29?,30+,31?,32+,33?,34?,35?/m1/s1 |
| InChIKey | NRTSAVOORBOQBR-BZEJJQKWSA-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 | 642.871 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMZ5686 |