| SpectraBase Spectrum ID |
ExOQoY5KQni |
| Name |
L-Tyrosinamide, N-acetyl-N,o-dimethyl-L-seryl-N-methyl-L-alanyl-N,N,N2-trimethyl-L-gl utaminyl-N,N,N2-trimethyl-L-glutaminyl-N-methylglycyl-N-methylglycyl- N,N,N.alpha.,o-tetramethyl- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
960.564417915 u |
| Formula |
C46H76N10O12 |
| InChI |
InChI=1S/C46H76N10O12/c1-30(52(11)46(66)37(29-67-16)53(12)31(2)57)42(62)55(14)35(23-25-39(59)48(5)6)45(65)56(15)34(22-24-38(58)47(3)4)44(64)51(10)27-40(60)50(9)28-41(61)54(13)36(43(63)49(7)8)26-32-18-20-33(68-17)21-19-32/h18-21,30,34-37H,22-29H2,1-17H3 |
| InChIKey |
MYPTZGCNPMOHJQ-UHFFFAOYSA-N |
| Molecular Weight |
961.172 g/mol |
| SMILES |
C(C(N(C(=O)C)C)COC)(N(C(C(N(C(C(N(C(C(N(CC(N(CC(N(C(C(N(C)C)=O)CC=1C=CC(=CC1)OC)C)=O)C)=O)C)=O)CCC(N(C)C)=O)C)=O)CCC(N(C)C)=O)C)=O)C)C)=O |
