LEVOMEFOLATE DIPYRIDOXAMINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H25N7O6.2C8H12N2O2
Molecular Weight	795.842
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of LEVOMEFOLATE DIPYRIDOXAMINE

Structure Search

SMILES

CC1=C(O)C(CN)=C(CO)C=N1.CC2=C(O)C(CN)=C(CO)C=N2.CN3[C@@H](CNC4=CC=C(C=C4)C(=O)N[C@@H](CCC(O)=O)C(O)=O)CNC5=C3C(=O)NC(N)=N5

InChI

InChIKey=VIWQXVJCSCYKGB-NJHZPMQHSA-N

InChI=1S/C20H25N7O6.2C8H12N2O2/c1-27-12(9-23-16-15(27)18(31)26-20(21)25-16)8-22-11-4-2-10(3-5-11)17(30)24-13(19(32)33)6-7-14(28)29;2*1-5-8(12)7(2-9)6(4-11)3-10-5/h2-5,12-13,22H,6-9H2,1H3,(H,24,30)(H,28,29)(H,32,33)(H4,21,23,25,26,31);2*3,11-12H,2,4,9H2,1H3/t12-,13-;;/m0../s1

HIDE SMILES / InChI

Molecular Formula	C20H25N7O6
Molecular Weight	459.4558
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	C8H12N2O2
Molecular Weight	168.1931
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:29:23 GMT 2023` Edited by `admin` on `Sat Dec 16 10:29:23 GMT 2023`
Record UNII	F9K8M3H8LF
Record Status	`Validated (UNII)`
Record Version