![MACHIPHILITANNIN_A;EPICATECHIN-(4-BETA->8,2-BETA->O->7)-[EPICATECHIN-(4-BETA->8)-EPICATECHIN-(4-BETA->6)]-EPICATECHIN-(4-BETA->8)-](/api/spectrum/IyD5R7jdStj/structure.png?h=300&w=458 "MACHIPHILITANNIN_A;EPICATECHIN-(4-BETA->8,2-BETA->O->7)-[EPICATECHIN-(4-BETA->8)-EPICATECHIN-(4-BETA->6)]-EPICATECHIN-(4-BETA->8)-")
| SpectraBase Compound ID | DOEYRXrL2uu |
|---|---|
| InChI | InChI=1S/C75H60O30/c76-28-16-42(89)50-48(18-28)100-67(24-2-7-32(79)38(85)12-24)63(96)55(50)53-45(92)22-46(93)54-57(65(98)68(102-71(53)54)25-3-8-33(80)39(86)13-25)60-62(95)59-56(52-44(91)21-36(83)30-20-47(94)66(101-70(30)52)23-1-6-31(78)37(84)11-23)64(97)69(26-4-9-34(81)40(87)14-26)103-72(59)61-58-51-43(90)17-29(77)19-49(51)104-75(74(58)99,105-73(60)61)27-5-10-35(82)41(88)15-27/h1-19,21-22,47,55-58,63-69,74,76-99H,20H2/t47-,55+,56-,57+,58+,63+,64+,65+,66-,67+,68+,69+,74+,75-/m0/s1 |
| InChIKey | MHQGUSXLFCTZRO-QVUYROPNSA-N |
| Mol Weight | 1441.3 g/mol |
| Molecular Formula | C75H60O30 |
| Exact Mass | 1440.316941 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IyD5R7jdStj |
|---|---|
| Name | MACHIPHILITANNIN_A;EPICATECHIN-(4-BETA->8,2-BETA->O->7)-[EPICATECHIN-(4-BETA->8)-EPICATECHIN-(4-BETA->6)]-EPICATECHIN-(4-BETA->8)- |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C75H60O30 |
| InChI | InChI=1S/C75H60O30/c76-28-16-42(89)50-48(18-28)100-67(24-2-7-32(79)38(85)12-24)63(96)55(50)53-45(92)22-46(93)54-57(65(98)68(102-71(53)54)25-3-8-33(80)39(86)13-25)60-62(95)59-56(52-44(91)21-36(83)30-20-47(94)66(101-70(30)52)23-1-6-31(78)37(84)11-23)64(97)69(26-4-9-34(81)40(87)14-26)103-72(59)61-58-51-43(90)17-29(77)19-49(51)104-75(74(58)99,105-73(60)61)27-5-10-35(82)41(88)15-27/h1-19,21-22,47,55-58,63-69,74,76-99H,20H2/t47-,55+,56-,57+,58+,63+,64+,65+,66-,67+,68+,69+,74+,75-/m0/s1 |
| InChIKey | MHQGUSXLFCTZRO-QVUYROPNSA-N |
| Literature Reference Author | H.C.LIN,S.S.LEE |
| Literature Reference Citation | J.NAT.PROD.,73,1375(2010) |
| Literature Reference DOI | 10.1021/np1002274 |
| Molecular Weight | 1441.283 g/mol |
| Sample ID | 36212 |
| Solvent | CD3OD |