| SpectraBase Compound ID | 8jgWJeHvCG0 |
|---|---|
| InChI | InChI=1S/C56H40O31/c57-18-2-1-12(3-19(18)58)48-26(65)6-14-27(83-48)10-20(59)32(37(14)66)35-34-36-33(45(74)47(76)46(34)75)31-17(9-25(64)41(70)44(31)73)55(80)87-51(50(35)86-56(36)81)49-28(84-52(77)13-4-21(60)38(67)22(61)5-13)11-82-53(78)15-7-23(62)39(68)42(71)29(15)30-16(54(79)85-49)8-24(63)40(69)43(30)72/h1-5,7-10,26,28,35,48-51,57-76H,6,11H2/t26?,28?,35-,48?,49?,50?,51?/m0/s1 |
| InChIKey | ZQRDOSBLXDFSAI-WZVHFKKDSA-N |
| Mol Weight | 1208.9 g/mol |
| Molecular Formula | C56H40O31 |
| Exact Mass | 1208.155354 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ho7JlLwm9oh |
|---|---|
| Name | STENOPHYLLANIN-B |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C56H40O31 |
| InChI | InChI=1S/C56H40O31/c57-18-2-1-12(3-19(18)58)48-26(65)6-14-27(83-48)10-20(59)32(37(14)66)35-34-36-33(45(74)47(76)46(34)75)31-17(9-25(64)41(70)44(31)73)55(80)87-51(50(35)86-56(36)81)49-28(84-52(77)13-4-21(60)38(67)22(61)5-13)11-82-53(78)15-7-23(62)39(68)42(71)29(15)30-16(54(79)85-49)8-24(63)40(69)43(30)72/h1-5,7-10,26,28,35,48-51,57-76H,6,11H2/t26?,28?,35-,48?,49?,50?,51?/m0/s1 |
| InChIKey | ZQRDOSBLXDFSAI-WZVHFKKDSA-N |
| Literature Reference Author | Z.H.JIANG,T.TANAKA,I.KOUNO |
| Literature Reference Citation | J.NAT.PROD.,62,425(1999) |
| Literature Reference DOI | 10.1021/np980361g |
| Molecular Weight | 1208.915 g/mol |
| Solvent | ACETONE-D6:D2O |
| Source File Reference | UWCP7808 |