VALOMACICLOVIR STEARATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C33H58N6O5
Molecular Weight	618.8508
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCCCCCCCCCCCCCCCCC(=O)OC[C@H](CCOC(=O)[C@@H](N)C(C)C)CN1C=NC2=C1NC(N)=NC2=O

InChI

InChIKey=ACBSZTQIFTYFGH-IAPPQJPRSA-N

InChI=1S/C33H58N6O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-27(40)44-23-26(20-21-43-32(42)28(34)25(2)3)22-39-24-36-29-30(39)37-33(35)38-31(29)41/h24-26,28H,4-23,34H2,1-3H3,(H3,35,37,38,41)/t26-,28+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C33H58N6O5
Molecular Weight	618.8508
Charge	0
Count

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

Description
Sources: https://www.ncbi.nlm.nih.gov/pubmed/19524486 | https://adisinsight.springer.com/drugs/800000996 | https://www.ncbi.nlm.nih.gov/pubmed/7486922

Omaciclovir (previously known as H2G), a cyclic guanosine analog that is structurally similar to acyclovir and was in clinical development for the treatment of herpesvirus infections. This drug acted against varicella-zoster virus (VZV), by the formation of high concentrations of relatively stable H2G-triphosphate, which is a potent inhibitor of the viral DNA polymerases. However, further development of this drug was discontinued.

Originator

Approval Year

PubMed

Title	Date	PubMed
Effect of (r)-9-[4-hydroxy-2-(hydroxymethyl)butyl]guanine (H2G) and AZT-lipid-PFA on human herpesvirus-6B infected cells.	2009 Sep	19524486
Activity of H2G on human herpesvirus-6B strains either sensitive or resistant to ganciclovir.	2010 Jun	20395169

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:48:22 GMT 2023` Edited by `admin` on `Fri Dec 15 15:48:22 GMT 2023`
Record UNII	506LI1B3A3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

VALOMACICLOVIR STEARATE

Official Name

English

OCTADECANOIC ACID, (2R)-2-((2-AMINO-1,6-DIHYDRO-6-OXO-9H-PURIN-9-YL)METHYL)-4-((2S)-2-AMINO-3-METHYL-1-OXOBUTOXY)BUTYL ESTER

Systematic Name

English

L-VALINE, 4-ESTER WITH 9-((R)-4-HYDROXY-2-(HYDROXYMETHYL)BUTYL)GUANINE, STEARATE (ESTER)

Common Name

English

L-VALINE, (3R)-3-((2-AMINO-1,6-DIHYDRO-6-OXO-9H-PURIN-9-YL)METHYL)-4-((1-OXOOCTADECYL)OXY)BUTYL ESTER

Common Name

English

VALOMACICLOVIR STEARATE [USAN]

Common Name

English

A-174606.0

Code

English

MIV 606

Code

English

Valomaciclovir stearate [WHO-DD]

Common Name

English

MIV-606

Code

English

ABT-606

Code

English

Classification Tree Code System Code

NCI_THESAURUS

C281