Isodesmosine-d4

Analyte Name

Isodesmosine-d4

Molecular Formula

C24 D4 H36 15N N4 O8

Molecular Weight

531.621

Accurate Mass

531.309

SMILES

[2H]C([2H])(CC[C@H](N)C(=O)O)C([2H])([2H])[15n+]1cc(CC[C@H](N)C(=O)O)cc(CC[C@H](N)C(=O)O)c1CCC[C@H](N)C(=O)O

InChI

InChI=1S/C24H39N5O8/c25-16(21(30)31)4-1-2-11-29-13-14(7-9-18(27)23(34)35)12-15(8-10-19(28)24(36)37)20(29)6-3-5-17(26)22(32)33/h12-13,16-19H,1-11,25-28H2,(H3-,30,31,32,33,34,35,36,37)/p+1/t16-,17-,18-,19-/m0/s1/i2D2,11D2,29+1

IUPAC

(2S)-2-amino-6-[2-[(4S)-4-amino-4-carboxybutyl]-3,5-bis[(3S)-3-amino-3-carboxypropyl](115N)pyridin-1-ium-1-yl]-5,5,6,6-tetradeuteriohexanoic acid

Unlabelled CAS Number

991-01-5

SIL Type

Nitrogen, Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat