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820242-23-7 | Glycine, L-leucyl-L-seryl-L-leucyl-L-threonyl-
CAS No: 820242-23-7 Catalog No: AG004Y69 MDL No:
Product Description
Catalog Number:
AG004Y69
Chemical Name:
Glycine, L-leucyl-L-seryl-L-leucyl-L-threonyl-
CAS Number:
820242-23-7
Molecular Formula:
C21H39N5O8
Molecular Weight:
489.5631
IUPAC Name:
2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-4-methylpentanoyl]amino]-3-hydroxypropanoyl]amino]-4-methylpentanoyl]amino]-3-hydroxybutanoyl]amino]acetic acid
InChI:
InChI=1S/C21H39N5O8/c1-10(2)6-13(22)18(31)25-15(9-27)20(33)24-14(7-11(3)4)19(32)26-17(12(5)28)21(34)23-8-16(29)30/h10-15,17,27-28H,6-9,22H2,1-5H3,(H,23,34)(H,24,33)(H,25,31)(H,26,32)(H,29,30)/t12-,13+,14+,15+,17+/m1/s1
InChI Key:
AOLVJMBOUZGWTP-MDLJMBGESA-N
SMILES:
OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)[C@H](O)C)CC(C)C)NC(=O)[C@H](CC(C)C)N
Properties
Complexity:
715
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
5
Defined Bond Stereocenter Count:
0
Exact Mass:
489.28g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
8
Isotope Atom Count:
0
Molecular Weight:
489.57g/mol
Monoisotopic Mass:
489.28g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
220A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-3.9
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