| CAS Number | 917099-01-5 |
| Catalog Number | AG00GXHC(AGN-PC-0VUY0C) |
| Chemical Name | (R)-Fmoc-4-amino-5-(1h-indol-3-yl)-pentanoic acid |
| IUPAC Name | (4R)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-5-(1H-indol-3-yl)pentanoic acid |
| InChI | InChI=1S/C28H26N2O4/c31-27(32)14-13-19(15-18-16-29-26-12-6-5-7-20(18)26)30-28(33)34-17-25-23-10-3-1-8-21(23)22-9-2-4-11-24(22)25/h1-12,16,19,25,29H,13-15,17H2,(H,30,33)(H,31,32)/t19-/m1/s1 |
| InChI Key | UOWIRRUTUJSIFI-LJQANCHMSA-N |
| MDL Number | MFCD06410971 |
| Molecular Formula | C28H26N2O4 |
| Molecular Weight | 454.5170 |
| SMILES | O=C(O)CC[C@H](CC1=CNC2=CC=CC=C12)NC(OCC3C4=CC=CC=C4C5=CC=CC=C53)=O |
| Synonyms | (R)-Fmoc-4-amino-5-(1h-indol-3-yl)-pentanoic acid,
917099-01-5,
C28H26N2O4,
(4R)-4-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}-5-(1H-indol-3-yl)pentanoic acid,
(R)-Fmoc-4-amino-5-(3-indolyl)pentanoic acid,
AC1MBSQR,
SCHEMBL800311,
4367AH,
MFCD06410971,
ZINC33369273,
A-7520,
(4R)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-5-(1H-indol-3-yl)pentanoic acid,
CID2756075,
-FMOC-4-AMINO-5- -PENTANOICACID,
4-(9H-fluoren-9-ylmethoxycarbonylamino)-5-(1H-indol-3-yl)pentanoic Acid,
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| Complexity | 693 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 454.189g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 34 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 454.526g/mol |
| Monoisotopic Mass | 454.189g/mol |
| Rotatable Bond Count | 9 |
| Topological Polar Surface Area | 91.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 5.1 |
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Certificate of Analysis
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