| SpectraBase Compound ID | 36mS8VSzZ3x |
|---|---|
| InChI | InChI=1S/C50H46O22/c1-21(51)61-33-17-40(66-26(6)56)44-41(18-33)72-48(32-12-14-36(63-23(3)53)39(16-32)65-25(5)55)50(70-30(10)60)46(44)45-42(67-27(7)57)20-37-34(49(45)69-29(9)59)19-43(68-28(8)58)47(71-37)31-11-13-35(62-22(2)52)38(15-31)64-24(4)54/h11-18,20,43,46-48,50H,19H2,1-10H3/t43-,46+,47+,48-,50+/m1/s1 |
| InChIKey | MGYPCSGYUMDLPH-UOTDEOPJSA-N |
| Mol Weight | 998.9 g/mol |
| Molecular Formula | C50H46O22 |
| Exact Mass | 998.248073 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J6HN03ynwO8 |
|---|---|
| Name | PROCYANIDIN-2B |
| Compound Number | 2BPROCYANIDIN-2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C50H46O22 |
| InChI | InChI=1S/C50H46O22/c1-21(51)61-33-17-40(66-26(6)56)44-41(18-33)72-48(32-12-14-36(63-23(3)53)39(16-32)65-25(5)55)50(70-30(10)60)46(44)45-42(67-27(7)57)20-37-34(49(45)69-29(9)59)19-43(68-28(8)58)47(71-37)31-11-13-35(62-22(2)52)38(15-31)64-24(4)54/h11-18,20,43,46-48,50H,19H2,1-10H3/t43-,46+,47+,48-,50+/m1/s1 |
| InChIKey | MGYPCSGYUMDLPH-UOTDEOPJSA-N |
| Literature Reference Author | L.BALAS,J.VERCAUTEREN |
| Literature Reference Citation | MAGN.RES.CHEM.,32,386(1994) |
| Literature Reference DOI | 10.1002/mrc.1260320703 |
| Molecular Weight | 998.902 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCP2206 |