| SpectraBase Compound ID | FLSbEclwHoy |
|---|---|
| InChI | InChI=1S/C89H147N21O25/c1-26-47(6)64(74(126)97-55(36-39-62(116)135-25)69(121)96-54(34-37-60(90)114)68(120)95-53(43-111)42-52-31-28-27-29-32-52)102-79(131)84(13,14)107-75(127)63(46(4)5)101-73(125)59-33-30-40-110(59)82(134)89(23,24)106-72(124)57(41-45(2)3)98-70(122)58(44-112)99-66(118)49(8)94-77(129)85(15,16)108-81(133)88(21,22)105-71(123)56(35-38-61(91)115)100-78(130)86(17,18)109-80(132)87(19,20)104-67(119)50(9)92-65(117)48(7)93-76(128)83(11,12)103-51(10)113/h27-29,31-32,45-50,53-59,63-64,111-112H,26,30,33-44H2,1-25H3,(H2,90,114)(H2,91,115)(H,92,117)(H,93,128)(H,94,129)(H,95,120)(H,96,121)(H,97,126)(H,98,122)(H,99,118)(H,100,130)(H,101,125)(H,102,131)(H,103,113)(H,104,119)(H,105,123)(H,106,124)(H,107,127)(H,108,133)(H,109,132)/t47-,48-,49-,50-,53-,54-,55-,56-,57-,58-,59+,63-,64-/m0/s1 |
| InChIKey | QBEYBEJKZGNOOI-NWNFJLDUSA-N |
| Mol Weight | 1911.3 g/mol |
| Molecular Formula | C89H147N21O25 |
| Exact Mass | 1910.087699 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | DRcmsOmeiWt |
|---|---|
| Name | TRICHORZIANINE-1896;TA-1896 |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C89H147N21O25 |
| InChI | InChI=1S/C89H147N21O25/c1-26-47(6)64(74(126)97-55(36-39-62(116)135-25)69(121)96-54(34-37-60(90)114)68(120)95-53(43-111)42-52-31-28-27-29-32-52)102-79(131)84(13,14)107-75(127)63(46(4)5)101-73(125)59-33-30-40-110(59)82(134)89(23,24)106-72(124)57(41-45(2)3)98-70(122)58(44-112)99-66(118)49(8)94-77(129)85(15,16)108-81(133)88(21,22)105-71(123)56(35-38-61(91)115)100-78(130)86(17,18)109-80(132)87(19,20)104-67(119)50(9)92-65(117)48(7)93-76(128)83(11,12)103-51(10)113/h27-29,31-32,45-50,53-59,63-64,111-112H,26,30,33-44H2,1-25H3,(H2,90,114)(H2,91,115)(H,92,117)(H,93,128)(H,94,129)(H,95,120)(H,96,121)(H,97,126)(H,98,122)(H,99,118)(H,100,130)(H,101,125)(H,102,131)(H,103,113)(H,104,119)(H,105,123)(H,106,124)(H,107,127)(H,108,133)(H,109,132)/t47-,48-,49-,50-,53-,54-,55-,56-,57-,58-,59+,63-,64-/m0/s1 |
| InChIKey | QBEYBEJKZGNOOI-NWNFJLDUSA-N |
| Literature Reference Author | I.PANIZEL,O.YARDEN,S.CARMELI |
| Literature Reference Citation | MAR.DRUGS,11,4937(2013) |
| Literature Reference DOI | 10.3390/md11124937 |
| Molecular Weight | 1911.272 g/mol |
| Source File Reference | UWBT6690 |