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Details

Stereochemistry ABSOLUTE
Molecular Formula C14H25N4O2.OTc
Molecular Weight 396.2796
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 2
Charge 0
Stereo Comments Assumed (R,R)-(E,E) isomer as in HM-PAO

SHOW SMILES / InChI
Structure of TECHNETIUM TC-99M CYCLOBUTYL PROPYLENE AMINE OXIME

SMILES

O=[99Tc+3].C[C@@H]([N-]CC1(C[N-][C@H](C)C(\C)=N\[O-])CCC1)C(\C)=N\O

InChI

InChIKey=SYRDLYTYTQOQFZ-NQPMITLXSA-M
InChI=1S/C14H26N4O2.O.Tc/c1-10(12(3)17-19)15-8-14(6-5-7-14)9-16-11(2)13(4)18-20;;/h10-11,19-20H,5-9H2,1-4H3;;/q-2;;+3/p-1/b17-12+,18-13+;;/t10-,11-;;/m1../s1/i;;1+1

HIDE SMILES / InChI

Approval Year

Name Type Language
TECHNETIUM TC-99M CYCLOBUTYL PROPYLENE AMINE OXIME
Common Name English
2-BUTANONE, 3,3'-(CYCLOBUTYLIDENEBIS(METHYLENEIMINO))BIS-, DIOXIME, TECHNETIUM-99 COMPLEX
Systematic Name English
TC-99M CB-PAO
Common Name English
TECHNETIUM-99TC, ((3,3'-(CYCLOBUTYLIDENEBIS(METHYLENEIMINO-.KAPPA.N))BIS(2-BUTANONE) DI(OXIMATO-.KAPPA.N))(3-))OXO-, (SP-5-15-(R*,R*))-
Systematic Name English
Code System Code Type Description
FDA UNII
JH18E0A8W1
Created by admin on Fri Dec 15 15:37:17 UTC 2023 , Edited by admin on Fri Dec 15 15:37:17 UTC 2023
PRIMARY
PUBCHEM
134160132
Created by admin on Fri Dec 15 15:37:17 UTC 2023 , Edited by admin on Fri Dec 15 15:37:17 UTC 2023
PRIMARY
CAS
131315-61-2
Created by admin on Fri Dec 15 15:37:17 UTC 2023 , Edited by admin on Fri Dec 15 15:37:17 UTC 2023
PRIMARY