| SpectraBase Compound ID | GEt2cV8nhGW |
|---|---|
| InChI | InChI=1S/C71H77Cl2N9O27/c1-24(2)13-36(82(5)52-56(91)58(93)60(52)103-6)64(96)80-50-53(88)27-8-11-39(33(72)15-27)105-41-17-29-18-42(59(41)109-70-61(57(92)55(90)43(23-83)107-70)108-45-22-71(4,75)62(94)25(3)104-45)106-40-12-9-28(16-34(40)73)54(89)51-68(100)79-49(69(101)102)32-19-30(84)20-38(86)46(32)31-14-26(7-10-37(31)85)47(65(97)81-51)78-66(98)48(29)77-63(95)35(21-44(74)87)76-67(50)99/h7-12,14-20,24-25,35-36,43,45,47-51,53-55,57,61-62,70,83-86,88-90,92,94H,13,21-23,75H2,1-6H3,(H2,74,87)(H,76,99)(H,77,95)(H,78,98)(H,79,100)(H,80,96)(H,81,97)(H,101,102)/t25-,35+,36-,43+,45-,47-,48-,49-,50-,51+,53-,54-,55+,57-,61+,62-,70-,71-/m1/s1 |
| InChIKey | XMOLHCGDPKJGJQ-YXQWHISBSA-N |
| Mol Weight | 1559.3 g/mol |
| Molecular Formula | C71H77Cl2N9O27 |
| Exact Mass | 1557.430594 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GfyTKchqbCg |
|---|---|
| Name | XMOLHCGDPKJGJQ-YXQWHISBSA-N |
| Compound Number | 12 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C71H77Cl2N9O27 |
| InChI | InChI=1S/C71H77Cl2N9O27/c1-24(2)13-36(82(5)52-56(91)58(93)60(52)103-6)64(96)80-50-53(88)27-8-11-39(33(72)15-27)105-41-17-29-18-42(59(41)109-70-61(57(92)55(90)43(23-83)107-70)108-45-22-71(4,75)62(94)25(3)104-45)106-40-12-9-28(16-34(40)73)54(89)51-68(100)79-49(69(101)102)32-19-30(84)20-38(86)46(32)31-14-26(7-10-37(31)85)47(65(97)81-51)78-66(98)48(29)77-63(95)35(21-44(74)87)76-67(50)99/h7-12,14-20,24-25,35-36,43,45,47-51,53-55,57,61-62,70,83-86,88-90,92,94H,13,21-23,75H2,1-6H3,(H2,74,87)(H,76,99)(H,77,95)(H,78,98)(H,79,100)(H,80,96)(H,81,97)(H,101,102)/t25-,35+,36-,43+,45-,47-,48-,49-,50-,51+,53-,54-,55+,57-,61+,62-,70-,71-/m1/s1 |
| InChIKey | XMOLHCGDPKJGJQ-YXQWHISBSA-N |
| Literature Reference Author | F.SZTARIESKAI,G.BATTA,P.HERCZEGH,A.BALAZS,J.JEKO,E.ROTH,P.T. SZABO,S.KARDOS,F.ROZ |
| Literature Reference Citation | J.ANTIBIOTICS,59,564(2006) |
| Literature Reference DOI | 10.1038/ja.2006.77 |
| Molecular Weight | 1559.342 g/mol |
| Solvent | - |
| Source File Reference | UWIR13624 |