| SpectraBase Compound ID | 2gO7vRQmSCu |
|---|---|
| InChI | InChI=1S/C53H93N7O13/c1-11-12-13-14-15-16-17-18-19-20-21-22-23-37-30-44(61)55-38(24-25-45(62)63)48(67)57-40(27-33(4)5)50(69)58-39(26-32(2)3)49(68)54-36(10)47(66)56-42(31-46(64)65)52(71)59-41(28-34(6)7)51(70)60-43(29-35(8)9)53(72)73-37/h32-43H,11-31H2,1-10H3,(H,54,68)(H,55,61)(H,56,66)(H,57,67)(H,58,69)(H,59,71)(H,60,70)(H,62,63)(H,64,65)/t36-,37+,38-,39-,40-,41-,42-,43-/m0/s1 |
| InChIKey | JOFCSIMHFQNTHA-SPIQOUAPSA-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 | 78I7reyDNQd |
|---|---|
| Name | JOFCSIMHFQNTHA-SPIQOUAPSA-N |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C53H93N7O13 |
| InChI | InChI=1S/C53H93N7O13/c1-11-12-13-14-15-16-17-18-19-20-21-22-23-37-30-44(61)55-38(24-25-45(62)63)48(67)57-40(27-33(4)5)50(69)58-39(26-32(2)3)49(68)54-36(10)47(66)56-42(31-46(64)65)52(71)59-41(28-34(6)7)51(70)60-43(29-35(8)9)53(72)73-37/h32-43H,11-31H2,1-10H3,(H,54,68)(H,55,61)(H,56,66)(H,57,67)(H,58,69)(H,59,71)(H,60,70)(H,62,63)(H,64,65)/t36-,37+,38-,39-,40-,41-,42-,43-/m0/s1 |
| InChIKey | JOFCSIMHFQNTHA-SPIQOUAPSA-N |
| Literature Reference Author | A.ROMANO,D.VITULLO,A.DIPIETRO,G.LIMA,V.LANZOTTI |
| Literature Reference Citation | J.NAT.PROD.,74,145(2011) |
| Literature Reference DOI | 10.1021/np100408y |
| Molecular Weight | 1036.361 g/mol |
| Sample ID | 37587 |
| Solvent | CD3OD |