CID 140079175

Rhp dipeptide

Structural Information

Molecular Formula
C11H21N5O4
SMILES
C1[C@H](CN([C@@H]1C(=O)O)C(=O)[C@H](CCCN=C(N)N)N)O
InChI
InChI=1S/C11H21N5O4/c12-7(2-1-3-15-11(13)14)9(18)16-5-6(17)4-8(16)10(19)20/h6-8,17H,1-5,12H2,(H,19,20)(H4,13,14,15)/t6-,7+,8+/m1/s1
InChIKey
MRSWIKOMENDNCQ-CSMHCCOUSA-N
Compound name
(2S,4R)-1-[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]-4-hydroxypyrrolidine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

287.15936 Da
Monoisotopic Mass

-5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.16664 166.0
[M+Na]+ 310.14858 166.2
[M+NH4]+ 305.19318 167.8
[M+K]+ 326.12252 169.1
[M-H]- 286.15208 163.3
[M+Na-2H]- 308.13403 162.9
[M]+ 287.15881 163.9
[M]- 287.15991 163.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.