| SpectraBase Compound ID | BRXb0EBURpw |
|---|---|
| InChI | InChI=1S/C49H36O27/c50-15-2-1-10(3-17(15)52)41-22(57)4-11-16(51)8-18(53)27(42(11)73-41)30-29-31-28(38(65)40(67)39(29)66)26-14(7-21(56)34(61)37(26)64)48(70)76-45(44(30)75-49(31)71)43-23(58)9-72-46(68)12-5-19(54)32(59)35(62)24(12)25-13(47(69)74-43)6-20(55)33(60)36(25)63/h1-3,5-8,22-23,30,41,43-45,50-67H,4,9H2/t22-,23+,30+,41-,43-,44-,45+/m1/s1 |
| InChIKey | VFRPPNXPLILJQH-OSFHRZBBSA-N |
| Mol Weight | 1056.8 g/mol |
| Molecular Formula | C49H36O27 |
| Exact Mass | 1056.144396 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7bqSVaeDbN0 |
|---|---|
| Name | CAMELLIATANNIN-A |
| Compound Number | IX |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C49H36O27 |
| InChI | InChI=1S/C49H36O27/c50-15-2-1-10(3-17(15)52)41-22(57)4-11-16(51)8-18(53)27(42(11)73-41)30-29-31-28(38(65)40(67)39(29)66)26-14(7-21(56)34(61)37(26)64)48(70)76-45(44(30)75-49(31)71)43-23(58)9-72-46(68)12-5-19(54)32(59)35(62)24(12)25-13(47(69)74-43)6-20(55)33(60)36(25)63/h1-3,5-8,22-23,30,41,43-45,50-67H,4,9H2/t22-,23+,30+,41-,43-,44-,45+/m1/s1 |
| InChIKey | VFRPPNXPLILJQH-OSFHRZBBSA-N |
| Literature Reference Author | J.ZHEXIONG,L.XIN |
| Literature Reference Citation | J.CHEM.PHARM.RES.,6,6,1770(2014) |
| Molecular Weight | 1056.809 g/mol |
| Solvent | ACETONE-D6:D2O |
| Source File Reference | UWBT13675 |