(Q27192542)

MLS001242596 (English)

11 October 2016

chemical formula

C₂₂H₄₅N₃

1 reference

MLS001242596 (English)

11 October 2016

canonical SMILES

CCCCC(CNC(CNC)C(C)CC)NCCC12CCC(C1)CC2

1 reference

MLS001242596 (English)

11 October 2016

isomeric SMILES

CCCC[C@H](CN[C@@H](CNC)[C@H](C)CC)NCCC12CCC(C1)CC2

1 reference

MLS001242596 (English)

InChI=1S/C22H45N3/c1-5-7-8-20(16-25-21(17-23-4)18(3)6-2)24-14-13-22-11-9-19(15-22)10-12-22/h18-21,23-25H,5-17H2,1-4H3/t18-,19?,20-,21+,22?/m1/s1

11 October 2016

Identifiers

InChI

1 reference

MLS001242596 (English)

HXWVJOJFQXWXFE-CAQIQVKASA-N

11 October 2016

InChIKey

2 references

MLS001242596 (English)

11 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(2R)-N~2~-[2-(Bicyclo[2.2.1]hept-1-yl)ethyl]-N~1~-[(2R,3R)-3-methyl-1-(methylamino)-2-pentanyl]-1,2-hexanediamine (English)

11 October 2016

1 reference

MLS001242596 (English)

11 October 2016

ChEBI ID

112438

mapping relation type

1 reference

(2R)-N2-[2-(4-bicyclo[2.2.1]heptanyl)ethyl]-N1-[(2R,3R)-3-methyl-1-(methylamino)pentan-2-yl]hexane-1,2-diamine (English)

11 October 2016

1 reference