| SpectraBase Compound ID | 19J9IfxWdCK |
|---|---|
| InChI | InChI=1S/C62H96N12O19/c1-8-33(5)50-58(88)69-42(31-75)55(85)65-38(9-2)54(84)71-51(34(6)76)59(89)67-40(21-18-35-16-19-37(93-7)20-17-35)61(91)73-25-10-13-43(73)56(86)68-41(28-36(77)29-47(79)46(78)27-32(3)4)52(82)60(90)66-39(22-23-48(63)80)53(83)64-30-49(81)72-24-12-15-45(72)62(92)74-26-11-14-44(74)57(87)70-50/h9,16-17,19-20,32-34,36,39-47,50-52,75-79,82H,8,10-15,18,21-31H2,1-7H3,(H2,63,80)(H,64,83)(H,65,85)(H,66,90)(H,67,89)(H,68,86)(H,69,88)(H,70,87)(H,71,84)/b38-9+/t33-,34+,36?,39-,40?,41?,42-,43-,44-,45-,46?,47?,50+,51-,52?/m0/s1 |
| InChIKey | ACFCYNJDAMJVRV-NPTOQFMUSA-N |
| Mol Weight | 1313.5 g/mol |
| Molecular Formula | C62H96N12O19 |
| Exact Mass | 1312.691469 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3xXXbZlBrHk |
|---|---|
| Name | LYNGBYAZOTHRIN_A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C62H96N12O19 |
| InChI | InChI=1S/C62H96N12O19/c1-8-33(5)50-58(88)69-42(31-75)55(85)65-38(9-2)54(84)71-51(34(6)76)59(89)67-40(21-18-35-16-19-37(93-7)20-17-35)61(91)73-25-10-13-43(73)56(86)68-41(28-36(77)29-47(79)46(78)27-32(3)4)52(82)60(90)66-39(22-23-48(63)80)53(83)64-30-49(81)72-24-12-15-45(72)62(92)74-26-11-14-44(74)57(87)70-50/h9,16-17,19-20,32-34,36,39-47,50-52,75-79,82H,8,10-15,18,21-31H2,1-7H3,(H2,63,80)(H,64,83)(H,65,85)(H,66,90)(H,67,89)(H,68,86)(H,69,88)(H,70,87)(H,71,84)/b38-9+/t33-,34+,36?,39-,40?,41?,42-,43-,44-,45-,46?,47?,50+,51-,52?/m0/s1 |
| InChIKey | ACFCYNJDAMJVRV-NPTOQFMUSA-N |
| Literature Reference Author | E.N.ZAINUDDIN,R.JANSEN,M.NIMTZ,V.WRAY,M.PREISITSCH,M.LALK,S. MUNDT |
| Literature Reference Citation | J.NAT.PROD.,72,1373(2009) |
| Literature Reference DOI | 10.1021/np8007792 |
| Molecular Weight | 1313.513 g/mol |
| Sample ID | 33274 |
| Solvent | 0.75G_SBF5:1.5ML_SO2ClF |