| SpectraBase Compound ID | 9F4mmJGOn8p |
|---|---|
| InChI | InChI=1S/C68H118O35/c1-13-15-19-23-38(24-21-18-16-17-20-22-37(71)25-41(72)88-12)95-67-58(49(80)45(76)40(97-67)27-89-63-50(81)46(77)42(73)33(8)91-63)103-68-59(48(79)44(75)39(26-69)96-68)102-66-52(83)56(99-60(85)28(3)14-2)55(36(11)94-66)100-65-53(84)57(101-64-51(82)47(78)43(74)34(9)92-64)54(35(10)93-65)98-62(87)30(5)32(7)90-61(86)29(4)31(6)70/h28-40,42-59,63-71,73-84H,13-27H2,1-12H3/t28-,29+,30+,31+,32+,33-,34-,35-,36+,37-,38-,39-,40-,42-,43-,44-,45-,46+,47+,48+,49+,50+,51+,52-,53-,54-,55+,56+,57-,58-,59-,63+,64-,65+,66+,67-,68+/m0/s1 |
| InChIKey | ZRIHLJHSVPVTKM-RCMWRKPISA-N |
| Mol Weight | 1495.7 g/mol |
| Molecular Formula | C68H118O35 |
| Exact Mass | 1494.745365 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 55SjFgSgJWs |
|---|---|
| Name | PM-3 |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C68H118O35 |
| InChI | InChI=1S/C68H118O35/c1-13-15-19-23-38(24-21-18-16-17-20-22-37(71)25-41(72)88-12)95-67-58(49(80)45(76)40(97-67)27-89-63-50(81)46(77)42(73)33(8)91-63)103-68-59(48(79)44(75)39(26-69)96-68)102-66-52(83)56(99-60(85)28(3)14-2)55(36(11)94-66)100-65-53(84)57(101-64-51(82)47(78)43(74)34(9)92-64)54(35(10)93-65)98-62(87)30(5)32(7)90-61(86)29(4)31(6)70/h28-40,42-59,63-71,73-84H,13-27H2,1-12H3/t28-,29+,30+,31+,32+,33-,34-,35-,36+,37-,38-,39-,40-,42-,43-,44-,45-,46+,47+,48+,49+,50+,51+,52-,53-,54-,55+,56+,57-,58-,59-,63+,64-,65+,66+,67-,68+/m0/s1 |
| InChIKey | ZRIHLJHSVPVTKM-RCMWRKPISA-N |
| Literature Reference Author | M.ONO,A.TAKIGAWA,T.MINENO,H.YOSHIMITSU,T.NOHARA,T.IKEDA,E.FU KUDA-TERAMACHI,N.NOD |
| Literature Reference Citation | J.NAT.PROD.,73,1846(2010) |
| Literature Reference DOI | 10.1021/np1004888 |
| Molecular Weight | 1495.664 g/mol |
| Sample ID | 37021 |
| Solvent | C5D5N |