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163918-03-4 | Glycine, L-alanyl-L-arginyl-L-leucyl- (9CI)
CAS No: 163918-03-4 Catalog No: AG001UJH MDL No:
Product Description
Catalog Number:
AG001UJH
Chemical Name:
Glycine, L-alanyl-L-arginyl-L-leucyl- (9CI)
CAS Number:
163918-03-4
Molecular Formula:
C17H33N7O5
Molecular Weight:
415.4878
IUPAC Name:
2-[[(2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-4-methylpentanoyl]amino]acetic acid
InChI:
InChI=1S/C17H33N7O5/c1-9(2)7-12(15(28)22-8-13(25)26)24-16(29)11(23-14(27)10(3)18)5-4-6-21-17(19)20/h9-12H,4-8,18H2,1-3H3,(H,22,28)(H,23,27)(H,24,29)(H,25,26)(H4,19,20,21)/t10-,11-,12-/m0/s1
InChI Key:
FLOLBLXEMADFRY-SRVKXCTJSA-N
SMILES:
CC(C[C@@H](C(=O)NCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](N)C)CCCNC(=N)N)C
Properties
Complexity:
605
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
415.254g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
7
Isotope Atom Count:
0
Molecular Weight:
415.495g/mol
Monoisotopic Mass:
415.254g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
215A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-4
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