| SpectraBase Compound ID | 744o61USPqZ |
|---|---|
| InChI | InChI=1S/C91H151N21O25/c1-27-49(6)65(75(128)98-56(37-40-64(118)137-26)69(122)97-55(35-38-62(92)116)68(121)96-54(45-113)44-53-32-29-28-30-33-53)103-79(132)85(12,13)107-72(125)59(43-48(4)5)100-74(127)61-34-31-41-112(61)83(136)91(24,25)108-73(126)58(42-47(2)3)99-70(123)60(46-114)102-78(131)87(16,17)110-82(135)90(22,23)111-81(134)89(20,21)106-71(124)57(36-39-63(93)117)101-77(130)86(14,15)109-80(133)88(18,19)105-67(120)51(8)94-66(119)50(7)95-76(129)84(10,11)104-52(9)115/h28-30,32-33,47-51,54-61,65,113-114H,27,31,34-46H2,1-26H3,(H2,92,116)(H2,93,117)(H,94,119)(H,95,129)(H,96,121)(H,97,122)(H,98,128)(H,99,123)(H,100,127)(H,101,130)(H,102,131)(H,103,132)(H,104,115)(H,105,120)(H,106,124)(H,107,125)(H,108,126)(H,109,133)(H,110,135)(H,111,134)/t49-,50-,51-,54-,55-,56-,57-,58-,59-,60-,61+,65-/m0/s1 |
| InChIKey | AADKKGKICVVASM-URYZIQKKSA-N |
| Mol Weight | 1939.3 g/mol |
| Molecular Formula | C91H151N21O25 |
| Exact Mass | 1938.118999 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 268SuLaKsVa |
|---|---|
| Name | TRICHORZIANINE-1924A;TA-1924A |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C91H151N21O25 |
| InChI | InChI=1S/C91H151N21O25/c1-27-49(6)65(75(128)98-56(37-40-64(118)137-26)69(122)97-55(35-38-62(92)116)68(121)96-54(45-113)44-53-32-29-28-30-33-53)103-79(132)85(12,13)107-72(125)59(43-48(4)5)100-74(127)61-34-31-41-112(61)83(136)91(24,25)108-73(126)58(42-47(2)3)99-70(123)60(46-114)102-78(131)87(16,17)110-82(135)90(22,23)111-81(134)89(20,21)106-71(124)57(36-39-63(93)117)101-77(130)86(14,15)109-80(133)88(18,19)105-67(120)51(8)94-66(119)50(7)95-76(129)84(10,11)104-52(9)115/h28-30,32-33,47-51,54-61,65,113-114H,27,31,34-46H2,1-26H3,(H2,92,116)(H2,93,117)(H,94,119)(H,95,129)(H,96,121)(H,97,122)(H,98,128)(H,99,123)(H,100,127)(H,101,130)(H,102,131)(H,103,132)(H,104,115)(H,105,120)(H,106,124)(H,107,125)(H,108,126)(H,109,133)(H,110,135)(H,111,134)/t49-,50-,51-,54-,55-,56-,57-,58-,59-,60-,61+,65-/m0/s1 |
| InChIKey | AADKKGKICVVASM-URYZIQKKSA-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 | 1939.326 g/mol |
| Source File Reference | UWBT6693 |