| SpectraBase Compound ID | GgApTMv285s |
|---|---|
| InChI | InChI=1S/C55H94O25/c1-11-12-18-21-34-22-19-16-14-13-15-17-20-23-36(59)75-47-44(78-52-42(65)41(64)43(32(9)71-52)76-50(67)26(3)29(6)57)33(10)72-55(48(47)77-51(68)27(4)30(7)58)80-46-40(63)38(61)35(24-69-49(66)25(2)28(5)56)74-54(46)79-45-39(62)37(60)31(8)70-53(45)73-34/h25-35,37-48,52-58,60-65H,11-24H2,1-10H3/t25?,26?,27?,28?,29?,30?,31-,32-,33+,34?,35-,37-,38-,39+,40+,41-,42-,43-,44+,45-,46-,47+,48-,52+,53+,54+,55+/m1/s1 |
| InChIKey | OFBIZKWQKSONBT-KPUKPULXSA-N |
| Mol Weight | 1155.3 g/mol |
| Molecular Formula | C55H94O25 |
| Exact Mass | 1154.608419 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EiVbj0cljQi |
|---|---|
| Name | TYRIANTHIN_2 |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C55H94O25 |
| InChI | InChI=1S/C55H94O25/c1-11-12-18-21-34-22-19-16-14-13-15-17-20-23-36(59)75-47-44(78-52-42(65)41(64)43(32(9)71-52)76-50(67)26(3)29(6)57)33(10)72-55(48(47)77-51(68)27(4)30(7)58)80-46-40(63)38(61)35(24-69-49(66)25(2)28(5)56)74-54(46)79-45-39(62)37(60)31(8)70-53(45)73-34/h25-35,37-48,52-58,60-65H,11-24H2,1-10H3/t25?,26?,27?,28?,29?,30?,31-,32-,33+,34?,35-,37-,38-,39+,40+,41-,42-,43-,44+,45-,46-,47+,48-,52+,53+,54+,55+/m1/s1 |
| InChIKey | OFBIZKWQKSONBT-KPUKPULXSA-N |
| Literature Reference Author | G.MIRON-LOPEZ.M.HERRERA-RUIZ,S.ESTRADO-SOTO,F.AGUIRRE-CRESPO ,L.VAZQUEZ-NAVARRETE |
| Literature Reference Citation | J.NAT.PROD.,70,557(2007) |
| Literature Reference DOI | 10.1021/np0604634 |
| Molecular Weight | 1155.336 g/mol |
| Sample ID | 30098 |
| Solvent | ACETONE-D6 |