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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H25N5O6
Molecular Weight 431.4424
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIDEAZAACYCLOTETRAHYDROFOLIC ACID

SMILES

NC1=NC(=O)C(CCCCC2=CC=C(C=C2)C(=O)N[C@@H](CCC(O)=O)C(O)=O)=C(N)N1

InChI

InChIKey=LNUHUIPUTGDPDG-AWEZNQCLSA-N
InChI=1S/C20H25N5O6/c21-16-13(18(29)25-20(22)24-16)4-2-1-3-11-5-7-12(8-6-11)17(28)23-14(19(30)31)9-10-15(26)27/h5-8,14H,1-4,9-10H2,(H,23,28)(H,26,27)(H,30,31)(H5,21,22,24,25,29)/t14-/m0/s1

HIDE SMILES / InChI

Molecular Formula C20H25N5O6
Molecular Weight 431.4424
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 16:35:01 GMT 2023
Edited
by admin
on Sat Dec 16 16:35:01 GMT 2023
Record UNII
Y2BS5U6OD9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIDEAZAACYCLOTETRAHYDROFOLIC ACID
Common Name English
N-(4-(4-((2,6-DIAMINO-1,4-DIHYDRO-4-OXOPYRIMIDIN)-5-YL)BUTYL)BENZOYL)-L-GLUTAMIC ACID
Systematic Name English
L-GLUTAMIC ACID, N-(4-(4-(2,6-DIAMINO-1,4-DIHYDRO-4-OXO-5-PYRIMIDINYL)BUTYL)BENZOYL)-
Common Name English
(2S)-2-((4-(4-(2,6-BIS(AZANYL)-4-OXIDANYLIDENE-1H-PYRIMIDIN-5-YL)BUTYL)PHENYL)CARBONYLAMINO)PENTANEDIOIC ACID
Systematic Name English
662U88
Code English
Code System Code Type Description
CAS
124656-55-9
Created by admin on Sat Dec 16 16:35:02 GMT 2023 , Edited by admin on Sat Dec 16 16:35:02 GMT 2023
PRIMARY
FDA UNII
Y2BS5U6OD9
Created by admin on Sat Dec 16 16:35:02 GMT 2023 , Edited by admin on Sat Dec 16 16:35:02 GMT 2023
PRIMARY
PUBCHEM
135884475
Created by admin on Sat Dec 16 16:35:02 GMT 2023 , Edited by admin on Sat Dec 16 16:35:02 GMT 2023
PRIMARY