O-DESMETHYL-CERIVASTATIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H31FNO5
Molecular Weight	444.5157
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	1
Charge	-1

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)C1=NC(C(C)C)=C(\C=C\[C@@H](O)C[C@@H](O)CC([O-])=O)C(C2=CC=C(F)C=C2)=C1CO

InChI

InChIKey=KUWDGQVSBKGOIJ-BGGMYYEUSA-M

InChI=1S/C25H32FNO5/c1-14(2)24-20(10-9-18(29)11-19(30)12-22(31)32)23(16-5-7-17(26)8-6-16)21(13-28)25(27-24)15(3)4/h5-10,14-15,18-19,28-30H,11-13H2,1-4H3,(H,31,32)/p-1/b10-9+/t18-,19-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C25H32FNO5
Molecular Weight	445.5237
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:35:46 UTC 2023` Edited by `admin` on `Sat Dec 16 08:35:46 UTC 2023`
Record UNII	OH43LBZISH
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

O-DESMETHYL-CERIVASTATIN

Common Name

English

O-DESMETHYL-CERIVASTATIN METABOLITE M1

Common Name

English

(E,3R,5S)-7-(4-(4-FLUOROPHENYL)-5-(HYDROXYMETHYL)-2,6-DIISOPROPYL-3-PYRIDYL)-3,5-DIHYDROXY-HEPT-6-ENOATE

Systematic Name

English

Code System Code Type Description

PUBCHEM

29977427

Created by admin on Sat Dec 16 08:35:46 UTC 2023 , Edited by admin on Sat Dec 16 08:35:46 UTC 2023

PRIMARY

CAS

189060-49-9

Created by admin on Sat Dec 16 08:35:46 UTC 2023 , Edited by admin on Sat Dec 16 08:35:46 UTC 2023

PRIMARY

FDA UNII

OH43LBZISH

Created by admin on Sat Dec 16 08:35:46 UTC 2023 , Edited by admin on Sat Dec 16 08:35:46 UTC 2023

PRIMARY

Related Record Type Details


					AM91H2KS67

CERIVASTATIN

PARENT -> METABOLITE

Comments:

CYP2C8 accounts for up to 60% of cerivastatin?s oxidation

Amount: