| SpectraBase Compound ID | FdPbnJJhUR4 |
|---|---|
| InChI | InChI=1S/C54H95N7O13/c1-11-12-13-14-15-16-17-18-19-20-21-22-23-24-38-31-45(62)56-39(25-26-46(63)64)49(68)58-41(28-34(4)5)51(70)59-40(27-33(2)3)50(69)55-37(10)48(67)57-43(32-47(65)66)53(72)60-42(29-35(6)7)52(71)61-44(30-36(8)9)54(73)74-38/h33-44H,11-32H2,1-10H3,(H,55,69)(H,56,62)(H,57,67)(H,58,68)(H,59,70)(H,60,72)(H,61,71)(H,63,64)(H,65,66)/t37-,38+,39-,40-,41-,42-,43-,44-/m0/s1 |
| InChIKey | JEOWGDWWVLJXAD-MQRRDULVSA-N |
| Mol Weight | 1050.4 g/mol |
| Molecular Formula | C54H95N7O13 |
| Exact Mass | 1049.698786 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DdaemwwmeB1 |
|---|---|
| Name | JEOWGDWWVLJXAD-MQRRDULVSA-N |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C54H95N7O13 |
| InChI | InChI=1S/C54H95N7O13/c1-11-12-13-14-15-16-17-18-19-20-21-22-23-24-38-31-45(62)56-39(25-26-46(63)64)49(68)58-41(28-34(4)5)51(70)59-40(27-33(2)3)50(69)55-37(10)48(67)57-43(32-47(65)66)53(72)60-42(29-35(6)7)52(71)61-44(30-36(8)9)54(73)74-38/h33-44H,11-32H2,1-10H3,(H,55,69)(H,56,62)(H,57,67)(H,58,68)(H,59,70)(H,60,72)(H,61,71)(H,63,64)(H,65,66)/t37-,38+,39-,40-,41-,42-,43-,44-/m0/s1 |
| InChIKey | JEOWGDWWVLJXAD-MQRRDULVSA-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 | 1050.387 g/mol |
| Sample ID | 37588 |
| Solvent | CD3OD |