| CAS Number | 159680-21-4 |
| Catalog Number | AG001RAH(AGN-PC-0WAMY1) |
| Chemical Name | L-Cysteine, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-S-[[(2-phenylacetyl)amino]methyl]- |
| IUPAC Name | (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[[(2-phenylacetyl)amino]methylsulfanyl]propanoic acid |
| InChI | InChI=1S/C27H26N2O5S/c30-25(14-18-8-2-1-3-9-18)28-17-35-16-24(26(31)32)29-27(33)34-15-23-21-12-6-4-10-19(21)20-11-5-7-13-22(20)23/h1-13,23-24H,14-17H2,(H,28,30)(H,29,33)(H,31,32)/t24-/m1/s1 |
| InChI Key | UBFAZPXACZPNQB-XMMPIXPASA-N |
| MDL Number | MFCD24369673 |
| Molecular Formula | C27H26N2O5S |
| Molecular Weight | 490.5707 |
| SMILES | C(OC(=O)N[C@@H](CSCNC(=O)Cc1ccccc1)C(=O)O)C1c2c(c3c1cccc3)cccc2 |
| Synonyms | 159680-21-4,
(S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(((2-phenylacetamido)methyl)thio)propanoic acid,
C27H26N2O5S,
AK119672,
DTXSID00855779,
8039AA,
MFCD24369673,
ZINC91296986,
AKOS016010660,
DS-5709,
ACM159680214,
AJ-129253,
AX8245088,
N-alpha-(9-Fluorenylmethyloxycarbonyl)-S-Phenylacetylaminomethyl)-L-cysteine,
N-{[(9H-Fluoren-9-yl)methoxy]carbonyl}-S-[(2-phenylacetamido)methyl]-D-cysteine,
N-Alpha-(9-fluorenylmethyloxycarbonyl)-s-(phenylacetylaminomethyl)-L-cysteine,
Fmoc-L-Cys(Phacm)-OH,
ACN-049833,
(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[[(2-phenylacetyl)amino]methylsulfanyl]propanoic acid,
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| Complexity | 706 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 490.156g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 35 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 490.574g/mol |
| Monoisotopic Mass | 490.156g/mol |
| Rotatable Bond Count | 11 |
| Topological Polar Surface Area | 130A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.3 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number