![BENZYL-6-[N-[(TERT.-BUTYLOXY)-CARBONYL]-L-PHENYLALANYL-L-LEUCYLAMINO]-6-DEOXY-BETA-D-GLUCOPYRANOSIDE](/api/spectrum/3SWeegpsq57/structure.png?h=300&w=458 "BENZYL-6-[N-[(TERT.-BUTYLOXY)-CARBONYL]-L-PHENYLALANYL-L-LEUCYLAMINO]-6-DEOXY-BETA-D-GLUCOPYRANOSIDE")
| SpectraBase Compound ID | BCc10QlaVc5 |
|---|---|
| InChI | InChI=1S/C33H47N3O9/c1-20(2)16-23(35-30(41)24(17-21-12-8-6-9-13-21)36-32(42)45-33(3,4)5)29(40)34-18-25-26(37)27(38)28(39)31(44-25)43-19-22-14-10-7-11-15-22/h6-15,20,23-28,31,37-39H,16-19H2,1-5H3,(H,34,40)(H,35,41)(H,36,42)/t23-,24-,25+,26+,27-,28+,31+/m0/s1 |
| InChIKey | PNZHKXNUQVJURF-KBRBYDDKSA-N |
| Mol Weight | 629.8 g/mol |
| Molecular Formula | C33H47N3O9 |
| Exact Mass | 629.33123 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3SWeegpsq57 |
|---|---|
| Name | BENZYL-6-[N-[(TERT.-BUTYLOXY)-CARBONYL]-L-PHENYLALANYL-L-LEUCYLAMINO]-6-DEOXY-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 12 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H47N3O9 |
| InChI | InChI=1S/C33H47N3O9/c1-20(2)16-23(35-30(41)24(17-21-12-8-6-9-13-21)36-32(42)45-33(3,4)5)29(40)34-18-25-26(37)27(38)28(39)31(44-25)43-19-22-14-10-7-11-15-22/h6-15,20,23-28,31,37-39H,16-19H2,1-5H3,(H,34,40)(H,35,41)(H,36,42)/t23-,24-,25+,26+,27-,28+,31+/m0/s1 |
| InChIKey | PNZHKXNUQVJURF-KBRBYDDKSA-N |
| Literature Reference Author | S.HORVAT,L.VARGA,J.HORVAT,A.PFUETZNER,H.SUHARTONO,H.RUEBSAME N-WAIGMANN |
| Literature Reference Citation | HELV.CHIM.ACTA,74,951(1991) |
| Literature Reference DOI | 10.1002/hlca.19910740505 |
| Molecular Weight | 629.751 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWVP5966 |