| SpectraBase Compound ID | 5XvLQOnOOG3 |
|---|---|
| InChI | InChI=1S/C51H80N2O19/c1-29-19-17-15-13-11-9-7-8-10-12-14-16-18-20-37(71-49-47(64)44(52-33(5)54)46(63)32(4)70-49)26-41-43(48(65)53-50(66)68-6)40(60)28-51(67,72-41)27-36(57)24-39(59)38(58)22-21-34(55)23-35(56)25-42(61)69-31(3)30(2)45(29)62/h7-8,10,12-20,29-32,34-41,43-47,49,55-60,62-64,67H,9,11,21-28H2,1-6H3,(H,52,54)(H,53,65,66)/b8-7+,12-10+,15-13+,16-14+,19-17+,20-18+/t29-,30-,31-,32+,34+,35+,36-,37-,38+,39+,40-,41+,43-,44-,45+,46+,47-,49-,51+/m0/s1 |
| InChIKey | YUJNZHZSLLCBQE-JCTBTHGTSA-N |
| Mol Weight | 1025.2 g/mol |
| Molecular Formula | C51H80N2O19 |
| Exact Mass | 1024.535528 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KLlhrnPndh4 |
|---|---|
| Name | 3'-N-ACETYL-AMPHOTERICIN-A-METHOXY-CARBONYL-METHYLAMIDE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C51H80N2O19 |
| InChI | InChI=1S/C51H80N2O19/c1-29-19-17-15-13-11-9-7-8-10-12-14-16-18-20-37(71-49-47(64)44(52-33(5)54)46(63)32(4)70-49)26-41-43(48(65)53-50(66)68-6)40(60)28-51(67,72-41)27-36(57)24-39(59)38(58)22-21-34(55)23-35(56)25-42(61)69-31(3)30(2)45(29)62/h7-8,10,12-20,29-32,34-41,43-47,49,55-60,62-64,67H,9,11,21-28H2,1-6H3,(H,52,54)(H,53,65,66)/b8-7+,12-10+,15-13+,16-14+,19-17+,20-18+/t29-,30-,31-,32+,34+,35+,36-,37-,38+,39+,40-,41+,43-,44-,45+,46+,47-,49-,51+/m0/s1 |
| InChIKey | YUJNZHZSLLCBQE-JCTBTHGTSA-N |
| Literature Reference Author | P.SOWINSKI,T.BIESZCZAD,J.PAWLAK,E.BOROWSKI |
| Literature Reference Citation | J.ANTIBIOTICS,49,1232(1996) |
| Literature Reference DOI | 10.7164/antibiotics.49.1232 |
| Molecular Weight | 1025.198 g/mol |
| Solvent | Unknown |
| Source File Reference | UWMP32 |