| SpectraBase Compound ID | BbQM5hlis4K |
|---|---|
| InChI | InChI=1S/C34H50ClNO10/c1-18-13-24(12-10-9-11-23-15-25(23)35)44-31(38)21(4)34(40)16-27(20(3)28(46-34)19(2)26(14-18)41-7)45-32-30(42-8)33(6,39)29(36-17-37)22(5)43-32/h10,12,14,17,19-30,32,39-40H,13,15-16H2,1-8H3,(H,36,37)/b12-10+,18-14+/t19-,20-,21-,22+,23+,24+,25+,26-,27+,28+,29+,30+,32+,33-,34+/m1/s1 |
| InChIKey | OBETWHWLWVQQSL-BLAYAKBTSA-N |
| Mol Weight | 668.2 g/mol |
| Molecular Formula | C34H50ClNO10 |
| Exact Mass | 667.312325 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2Bz5Pu7G4R3 |
|---|---|
| Name | PHORBASIDE_I;MAJOR_ROTAMER |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H50ClNO10 |
| InChI | InChI=1S/C34H50ClNO10/c1-18-13-24(12-10-9-11-23-15-25(23)35)44-31(38)21(4)34(40)16-27(20(3)28(46-34)19(2)26(14-18)41-7)45-32-30(42-8)33(6,39)29(36-17-37)22(5)43-32/h10,12,14,17,19-30,32,39-40H,13,15-16H2,1-8H3,(H,36,37)/b12-10+,18-14+/t19-,20-,21-,22+,23+,24+,25+,26-,27+,28+,29+,30+,32+,33-,34+/m1/s1 |
| InChIKey | OBETWHWLWVQQSL-BLAYAKBTSA-N |
| Literature Reference Author | D.S.DALISAY,T.F.MOLINSKI |
| Literature Reference Citation | J.NAT.PROD.,73,679(2010) |
| Literature Reference DOI | 10.1021/np1000297 |
| Molecular Weight | 668.225 g/mol |
| Sample ID | 35325 |
| Solvent | CDCl3 |