SpectraBase Compound ID | Ci3zstkNO0L |
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InChI | InChI=1S/C34H65NO10S/c1-3-4-5-13-16-19-29(36)20-17-14-11-9-7-6-8-10-12-15-18-21-34(41)45-28(2)26-31(38)32(39)27-30(37)22-23-33(40)35-24-25-46(42,43)44/h16,19,28-32,36-39H,3-15,17-18,20-27H2,1-2H3,(H,35,40)(H,42,43,44)/p-1/b19-16+/t28?,29?,30-,31+,32-/m1/s1 |
InChIKey | LCMJGVARRXLCMN-SWWCHEGGSA-M |
Mol Weight | 678.9 g/mol |
Molecular Formula | C34H64NO10S |
Exact Mass | 678.425093 g/mol |
SpectraBase Spectrum ID | 64rn1vOK0dv |
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Name | CARTERIOSULFONIC_ACID_C |
Compound Number | 3 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C34H64NO10S |
InChI | InChI=1S/C34H65NO10S/c1-3-4-5-13-16-19-29(36)20-17-14-11-9-7-6-8-10-12-15-18-21-34(41)45-28(2)26-31(38)32(39)27-30(37)22-23-33(40)35-24-25-46(42,43)44/h16,19,28-32,36-39H,3-15,17-18,20-27H2,1-2H3,(H,35,40)(H,42,43,44)/p-1/b19-16+/t28?,29?,30-,31+,32-/m1/s1 |
InChIKey | LCMJGVARRXLCMN-SWWCHEGGSA-M |
Literature Reference Author | M.W.B.MCCULLOCH,T.S.BUGNI,G.P.CONCEPSION,G.S.COOMBS,M.K.HARP ER,S.KAUR,G.C.MANGAL |
Literature Reference Citation | J.NAT.PROD.,72,1651(2009) |
Literature Reference DOI | 10.1021/np900336f |
Molecular Weight | 678.943 g/mol |
Sample ID | 33544 |
Solvent | DMSO-D6 |