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Substance Name: Vaxfectin
RN: 370108-99-9
InChIKey: LTOCXIVQWDANEX-UXCYUTBZSA-M

Note

  • Used in formulating tuberculosis DNA vaccines.

Molecular Weight

  • 1450.0677
 
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Names and Synonyms

Name of Substance

  • Vaxfectin

Synonym

  • Aminopropyl-dimethyl-myristoyleyloxy-propanaminium bromide-diphytanoylphosphatidyl-ethanolamine

Registry Numbers

CAS Registry Number

  • 370108-99-9

System Generated Number

  • 0370108999

Structure Descriptors

InChI

1S/C45H90NO8P.C36H73N2O2.BrH/c1-35(2)17-11-19-37(5)21-13-23-39(7)25-15-27-41(9)31-44(47)51-33-43(34-53-55(49,50)52-30-29-46)54-45(48)32-42(10)28-16-26-40(8)24-14-22-38(6)20-12-18-36(3)4;1-5-7-9-11-13-15-17-19-21-23-25-27-32-39-35-36(34-38(3,4)31-29-30-37)40-33-28-26-24-22-20-18-16-14-12-10-8-6-2;/h35-43H,11-34,46H2,1-10H3,(H,49,50);11-14,36H,5-10,15-35,37H2,1-4H3;1H/q;+1;/p-1/b;13-11-,14-12-;/t37?,38?,39?,40?,41?,42?,43-;;/m1../s1

InChIKey

LTOCXIVQWDANEX-UXCYUTBZSA-M

Smiles

[Br-].CCCC\C=C/CCCCCCCCOCC(C[N+](C)(C)CCCN)OCCCCCCCC\C=C/CCCC.CC(C)CCCC(C)CCCC(C)CCCC(C)CC(=O)OC[C@H](COP(=O)(O)OCCN)OC(=O)CC(C)CCCC(C)CCCC(C)CCCC(C)C