| CAS Number | 1313054-60-2 |
| Catalog Number | AG00HSFC(AGN-PC-0WR44D) |
| Chemical Name | Fmoc-d-hoarg(pbf)-oh |
| IUPAC Name | 6-[[amino-[(2,2,4,6,7-pentamethyl-3H-1-benzofuran-5-yl)sulfonylamino]methylidene]amino]-2-(9H-fluoren-9-ylmethoxycarbonylamino)hexanoic acid |
| InChI | InChI=1S/C35H42N4O7S/c1-20-21(2)31(22(3)27-18-35(4,5)46-30(20)27)47(43,44)39-33(36)37-17-11-10-16-29(32(40)41)38-34(42)45-19-28-25-14-8-6-12-23(25)24-13-7-9-15-26(24)28/h6-9,12-15,28-29H,10-11,16-19H2,1-5H3,(H,38,42)(H,40,41)(H3,36,37,39) |
| InChI Key | DOGZBRBJANHMLA-UHFFFAOYSA-N |
| MDL Number | MFCD15142012 |
| Molecular Formula | C35H42N4O7S |
| Molecular Weight | 662.7956 |
| SMILES | O=C(N[C@@H](C(=O)O)CCCCNC(=N)NS(=O)(=O)c1c(C)c(C)c2c(c1C)CC(O2)(C)C)OCC1c2ccccc2c2c1cccc2 |
| Synonyms | Fmoc-D-HoArg(Pbf)-OH,
1313054-60-2,
AK-49763,
SY018021,
MFCD03093571 (95%),
(S)-2-(Fmoc-amino)-6-[3-(2,2,4,6,7-pentamethyl-2,3-dihydrobenzofuran-5-ylsulfonyl)guanidino]hexanoic Acid,
Nalpha-Fmoc-Nomega-(2,2,4,6,7-pentamethyl-2,3-dihydrobenzo[b]furan-5-ylsulfonyl)-L-beta-homoarginine,
Fmoc-HoArg(Pbf)-OH,
Fmoc-Homoarg(Pbf)-OH,
1159680-21-3,
401915-53-5,
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| Complexity | 1230 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 662.277g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 47 |
| Hydrogen Bond Acceptor Count | 8 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 662.802g/mol |
| Monoisotopic Mass | 662.277g/mol |
| Rotatable Bond Count | 13 |
| Topological Polar Surface Area | 178A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 5.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number