| SpectraBase Spectrum ID |
338wEOMiYRj |
| Name |
Methyl (2S)-4-{4-[(2S)-2-{[(Benzyloxy)carbonyl]amino}-3-(tert-butoxy)-3-oxopropyl]-1,3-benzoxazol-2-yl}-2-({(2S)-2-[(tert-butoxycarbonyl)amino]-3-(benzyloxycarbonyl)propanoyl]amino)butanoate |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C43H52N4O12 |
| InChI |
InChI=1S/C43H52N4O12/c1-42(2,3)58-39(51)32(46-40(52)56-26-28-17-12-9-13-18-28)23-29-19-14-20-33-36(29)47-34(57-33)22-21-30(38(50)54-7)44-37(49)31(45-41(53)59-43(4,5)6)24-35(48)55-25-27-15-10-8-11-16-27/h8-20,30-32H,21-26H2,1-7H3,(H,44,49)(H,45,53)(H,46,52)/t30-,31?,32-/m0/s1 |
| InChIKey |
FTEXVAPCWKKISE-GFMLHKOCSA-N |
| Molecular Weight |
816.905 g/mol |
| SMILES |
N(C(=O)OCc1ccccc1)[C@@](Cc1cccc2c1nc(CC[C@](NC(C(CC(=O)OCc1ccccc1)NC(OC(C)(C)C)=O)=O)(C(=O)OC)[H])o2)(C(OC(C)(C)C)=O)[H] |
| SPLASH |
splash10-0007-9400000000-85a637226575434a3768 |
| Source of Spectrum |
J-67-4890-20 |
| Synonyms |
Methyl (2S)-2-(benzyl 3-{[(tert-butoxy)carbonyl]amino}-3-formamidopropanoate)-4-{4-[(2S)-2-{[(benzyloxy)carbonyl]amino}-3-(tert-butoxy)-3-oxopropyl]-1,3-benzoxazol-2-yl}butanoate |
| Wiley ID |
1570327 |
![Methyl (2S)-4-{4-[(2S)-2-{[(benzyloxy)carbonyl]amino}-3-(tert-butoxy)-3-oxopropyl]-1,3-benzoxazol-2-yl}-2-({(2S)-2-[(tert-butoxycarbonyl)amino]-3-(benzyloxycarbonyl)propanoyl]amino)butanoate](/api/spectrum/338wEOMiYRj/structure.png?h=300&w=458 "Methyl (2S)-4-{4-[(2S)-2-{[(benzyloxy)carbonyl]amino}-3-(tert-butoxy)-3-oxopropyl]-1,3-benzoxazol-2-yl}-2-({(2S)-2-[(tert-butoxycarbonyl)amino]-3-(benzyloxycarbonyl)propanoyl]amino)butanoate")
