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1246302-99-7 | L-Serine, N-[(9Z)-1-oxo-9-octadecen-1-yl]-, sodium salt (1:1)
CAS No: 1246302-99-7 Catalog No: AG000MHZ MDL No:MFCD11878489
Product Description
Catalog Number:
AG000MHZ
Chemical Name:
L-Serine, N-[(9Z)-1-oxo-9-octadecen-1-yl]-, sodium salt (1:1)
CAS Number:
1246302-99-7
Molecular Formula:
C21H38NNaO4
Molecular Weight:
391.5205
MDL Number:
MFCD11878489
IUPAC Name:
sodium;(2S)-3-hydroxy-2-[[(Z)-octadec-9-enoyl]amino]propanoate
InChI:
InChI=1S/C21H39NO4.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(24)22-19(18-23)21(25)26;/h9-10,19,23H,2-8,11-18H2,1H3,(H,22,24)(H,25,26);/q;+1/p-1/b10-9-;/t19-;/m0./s1
InChI Key:
PJFWBMMXYSJVIF-PUXKSNPUSA-M
SMILES:
CCCCCCCC/C=C\CCCCCCCC(=O)N[C@H](C(=O)[O-])CO.[Na+]
Properties
Complexity:
388
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
1
Exact Mass:
391.27g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
391.528g/mol
Monoisotopic Mass:
391.27g/mol
Rotatable Bond Count:
18
Topological Polar Surface Area:
89.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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