| SpectraBase Compound ID | 6Xr0OXFBdao |
|---|---|
| InChI | InChI=1S/C53H93N7O13/c1-12-13-14-15-16-17-18-19-20-21-22-23-36-29-42(61)54-37(24-25-43(62)63)47(66)59-45(34(8)9)51(70)56-39(27-32(4)5)50(69)60-46(35(10)11)52(71)57-40(30-44(64)65)49(68)55-38(26-31(2)3)48(67)58-41(28-33(6)7)53(72)73-36/h31-41,45-46H,12-30H2,1-11H3,(H,54,61)(H,55,68)(H,56,70)(H,57,71)(H,58,67)(H,59,66)(H,60,69)(H,62,63)(H,64,65)/t36-,37+,38+,39+,40+,41+,45+,46+/m1/s1 |
| InChIKey | FQASSPLXNPVMIT-XOOSUAOSSA-N |
| Mol Weight | 1036.4 g/mol |
| Molecular Formula | C53H93N7O13 |
| Exact Mass | 1035.683136 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6uR7i6zHUX3 |
|---|---|
| Name | FQASSPLXNPVMIT-XOOSUAOSSA-N |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C53H93N7O13 |
| InChI | InChI=1S/C53H93N7O13/c1-12-13-14-15-16-17-18-19-20-21-22-23-36-29-42(61)54-37(24-25-43(62)63)47(66)59-45(34(8)9)51(70)56-39(27-32(4)5)50(69)60-46(35(10)11)52(71)57-40(30-44(64)65)49(68)55-38(26-31(2)3)48(67)58-41(28-33(6)7)53(72)73-36/h31-41,45-46H,12-30H2,1-11H3,(H,54,61)(H,55,68)(H,56,70)(H,57,71)(H,58,67)(H,59,66)(H,60,69)(H,62,63)(H,64,65)/t36-,37+,38+,39+,40+,41+,45+,46+/m1/s1 |
| InChIKey | FQASSPLXNPVMIT-XOOSUAOSSA-N |
| Literature Reference Author | A.ROMANO,D.VITULLO,M.SENATORE,G.LIMA,V.LANZOTTI |
| Literature Reference Citation | J.NAT.PROD.,76,2019(2013) |
| Literature Reference DOI | 10.1021/np400119n |
| Molecular Weight | 1036.361 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMZ43387 |