| SpectraBase Compound ID | HjwaJQ4TQnH |
|---|---|
| InChI | InChI=1S/C54H68N10O14/c1-31(2)22-24-78-36-18-16-35(17-19-36)27-38-48(71)56-30-45(68)63-47(32(3)65)53(76)57-29-44(67)58-37(20-21-46(69)70)49(72)59-39(25-33-11-6-4-7-12-33)50(73)60-40(26-34-13-8-5-9-14-34)51(74)62-41(28-43(55)66)54(77)64-23-10-15-42(64)52(75)61-38/h4-9,11-14,16-19,22,32,37-42,47,65H,10,15,20-21,23-30H2,1-3H3,(H2,55,66)(H,56,71)(H,57,76)(H,58,67)(H,59,72)(H,60,73)(H,61,75)(H,62,74)(H,63,68)(H,69,70)/t32-,37+,38-,39-,40-,41-,42-,47+/m0/s1 |
| InChIKey | LXDPLRBOMKUKGF-OCYXQKJESA-N |
| Mol Weight | 1081.2 g/mol |
| Molecular Formula | C54H68N10O14 |
| Exact Mass | 1080.491647 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 1lz8Q8dsoY9 |
|---|---|
| Name | PRENYLAGARAMIDE-A;CYClO-(PTYR-GLY-THR-GLY-GLU-PHE-PHE-ASN-PRO) |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C54H68N10O14 |
| InChI | InChI=1S/C54H68N10O14/c1-31(2)22-24-78-36-18-16-35(17-19-36)27-38-48(71)56-30-45(68)63-47(32(3)65)53(76)57-29-44(67)58-37(20-21-46(69)70)49(72)59-39(25-33-11-6-4-7-12-33)50(73)60-40(26-34-13-8-5-9-14-34)51(74)62-41(28-43(55)66)54(77)64-23-10-15-42(64)52(75)61-38/h4-9,11-14,16-19,22,32,37-42,47,65H,10,15,20-21,23-30H2,1-3H3,(H2,55,66)(H,56,71)(H,57,76)(H,58,67)(H,59,72)(H,60,73)(H,61,75)(H,62,74)(H,63,68)(H,69,70)/t32-,37+,38-,39-,40-,41-,42-,47+/m0/s1 |
| InChIKey | LXDPLRBOMKUKGF-OCYXQKJESA-N |
| Literature Reference Author | M.MURAKAMI,Y.ITOU,K.ISHIDA,H.J.SHIN |
| Literature Reference Citation | J.NAT.PROD.,62,752(1999) |
| Literature Reference DOI | 10.1021/np980396g |
| Molecular Weight | 1081.193 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWCP7606 |