FOSTEMSAVIR DIHYDRATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C25H26N7O8P.2H2O
Molecular Weight	619.5204
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

O.O.COC1=CN=C(N2C=NC(C)=N2)C3=C1C(=CN3COP(O)(O)=O)C(=O)C(=O)N4CCN(CC4)C(=O)C5=CC=CC=C5

InChI

InChIKey=IHIJOICKAIGEIR-UHFFFAOYSA-N

InChI=1S/C25H26N7O8P.2H2O/c1-16-27-14-32(28-16)23-21-20(19(39-2)12-26-23)18(13-31(21)15-40-41(36,37)38)22(33)25(35)30-10-8-29(9-11-30)24(34)17-6-4-3-5-7-17;;/h3-7,12-14H,8-11,15H2,1-2H3,(H2,36,37,38);2*1H2

HIDE SMILES / InChI

Molecular Formula	H2O
Molecular Weight	18.0153
Charge	0
Count

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

Molecular Formula	C25H26N7O8P
Molecular Weight	583.4898
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 01:01:27 UTC 2023` Edited by `admin` on `Sat Dec 16 01:01:27 UTC 2023`
Record UNII	Z3P1PLZ348
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

FOSTEMSAVIR DIHYDRATE

Common Name

English

1,2-ETHANEDIONE, 1-(4-BENZOYL-1-PIPERAZINYL)-2-(4-METHOXY-7-(3-METHYL-1H-1,2,4-TRIAZOL-1-YL)-1-((PHOSPHONOOXY)METHYL)-1H-PYRROLO(2,3-C)PYRIDIN-3-YL)-, HYDRATE (1:2)

Systematic Name

English

BMS-663068 DIHYDRATE

Common Name

English

Code System Code Type Description

FDA UNII

Z3P1PLZ348

Created by admin on Sat Dec 16 01:01:27 UTC 2023 , Edited by admin on Sat Dec 16 01:01:27 UTC 2023

PRIMARY

PUBCHEM

76956413

Created by admin on Sat Dec 16 01:01:27 UTC 2023 , Edited by admin on Sat Dec 16 01:01:27 UTC 2023

PRIMARY

CAS

942117-71-7

Created by admin on Sat Dec 16 01:01:27 UTC 2023 , Edited by admin on Sat Dec 16 01:01:27 UTC 2023

PRIMARY

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