2',3',5'-Tri-O-Benzoyl-5-Azacytidine

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C29H24N4O8
Molecular Weight	556.5229
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2',3',5'-Tri-O-Benzoyl-5-Azacytidine

Structure Search

SMILES

NC1=NC(=O)N(C=N1)[C@@H]2O[C@H](COC(=O)C3=CC=CC=C3)[C@@H](OC(=O)C4=CC=CC=C4)[C@H]2OC(=O)C5=CC=CC=C5

InChI

InChIKey=XMEBCSNOBVAIDQ-MOUTVQLLSA-N

InChI=1S/C29H24N4O8/c30-28-31-17-33(29(37)32-28)24-23(41-27(36)20-14-8-3-9-15-20)22(40-26(35)19-12-6-2-7-13-19)21(39-24)16-38-25(34)18-10-4-1-5-11-18/h1-15,17,21-24H,16H2,(H2,30,32,37)/t21-,22-,23-,24-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C29H24N4O8
Molecular Weight	556.5229
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 18:40:50 GMT 2023` Edited by `admin` on `Sat Dec 16 18:40:50 GMT 2023`
Record UNII	KY8NK5JU5K
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2',3',5'-Tri-O-Benzoyl-5-Azacytidine

Common Name

English

1,3,5-Triazin-2(1H)-one, 4-amino-1-(2,3,5-tri-O-benzoyl-β-D-ribofuranosyl)-

Systematic Name

English

NSC-291931

Code

English

4-Amino-1-(2,3,5-tri-O-benzoyl-β-D-ribofuranosyl)-1,3,5-triazin-2(1H)-one

Systematic Name

English

5-Azacytidine 2′,3′,5′-tribenzoate

Common Name

English

Code System Code Type Description

FDA UNII

KY8NK5JU5K