N-nitroso-levoleucovorin-1

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H20N8O8
Molecular Weight	500.4216
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	-2

SHOW SMILES / InChI

Structure Search

SMILES

NC1=NC(=O)C2=C(N1)N(C[C@H](CNC3=CC=C(C=C3)C(=O)N[C@@H](CCC([O-])=O)C([O-])=O)N2C=O)N=O

InChI

InChIKey=LFGONTFPPSBGOV-STQMWFEESA-L

InChI=1S/C20H22N8O8/c21-20-24-16-15(18(33)25-20)27(9-29)12(8-28(16)26-36)7-22-11-3-1-10(2-4-11)17(32)23-13(19(34)35)5-6-14(30)31/h1-4,9,12-13,22H,5-8H2,(H,23,32)(H,30,31)(H,34,35)(H3,21,24,25,33)/p-2/t12-,13-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C20H20N8O8
Molecular Weight	500.4216
Charge	-2
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 18:25:07 GMT 2025` Edited by `admin` on `Wed Apr 02 18:25:07 GMT 2025`
Record UNII	2VP7R4SU4E
Record Status	`Validated (UNII)`
Record Version