U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C20H21N7O6
Molecular Weight 455.424
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FOLIC ACID 5-METHYL ESTER

SMILES

COC(=O)CC[C@H](NC(=O)C1=CC=C(NCC2=NC3=C(N=C2)N=C(N)NC3=O)C=C1)C(O)=O

InChI

InChIKey=BNZPKFAGFVCCMO-ZDUSSCGKSA-N
InChI=1S/C20H21N7O6/c1-33-14(28)7-6-13(19(31)32)25-17(29)10-2-4-11(5-3-10)22-8-12-9-23-16-15(24-12)18(30)27-20(21)26-16/h2-5,9,13,22H,6-8H2,1H3,(H,25,29)(H,31,32)(H3,21,23,26,27,30)/t13-/m0/s1

HIDE SMILES / InChI

Molecular Formula C20H21N7O6
Molecular Weight 455.424
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 08:18:17 GMT 2023
Edited
by admin
on Sat Dec 16 08:18:17 GMT 2023
Record UNII
N3K9WO9CMA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FOLIC ACID 5-METHYL ESTER
Common Name English
L-GLUTAMIC ACID, N-(4-(((2-AMINO-1,4-DIHYDRO-4-OXO-6-PTERIDINYL)METHYL)AMINO)BENZOYL)-, 5-METHYL ESTER
Systematic Name English
L-GLUTAMIC ACID, N-(4-(((2-AMINO-3,4-DIHYDRO-4-OXO-6-PTERIDINYL)METHYL)AMINO)BENZOYL)-, 5-METHYL ESTER
Systematic Name English
FOLIC ACID, METHYL-
Common Name English
Code System Code Type Description
PUBCHEM
135489578
Created by admin on Sat Dec 16 08:18:17 GMT 2023 , Edited by admin on Sat Dec 16 08:18:17 GMT 2023
PRIMARY
EPA CompTox
DTXSID60220404
Created by admin on Sat Dec 16 08:18:17 GMT 2023 , Edited by admin on Sat Dec 16 08:18:17 GMT 2023
PRIMARY
FDA UNII
N3K9WO9CMA
Created by admin on Sat Dec 16 08:18:17 GMT 2023 , Edited by admin on Sat Dec 16 08:18:17 GMT 2023
PRIMARY
CAS
70114-87-3
Created by admin on Sat Dec 16 08:18:17 GMT 2023 , Edited by admin on Sat Dec 16 08:18:17 GMT 2023
NON-SPECIFIC SUBSTITUTION
CAS
53464-60-1
Created by admin on Sat Dec 16 08:18:17 GMT 2023 , Edited by admin on Sat Dec 16 08:18:17 GMT 2023
PRIMARY