(1S,3R,7S,8S,8AR)-3,7-DIMETHYL-8-(2-((2R)-6-OXO-3,6-DIHYDRO-2H-PYRAN-2-YL)ETHYL)-1,2,3,7,8,8A-HEXAHYDRONAPHTHALEN-1-YL (2S)-2-METHYLBUTANOATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C24H34O4
Molecular Weight	386.5244
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (1S,3R,7S,8S,8AR)-3,7-DIMETHYL-8-(2-((2R)-6-OXO-3,6-DIHYDRO-2H-PYRAN-2-YL)ETHYL)-1,2,3,7,8,8A-HEXAHYDRONAPHTHALEN-1-YL (2S)-2-METHYLBUTANOATE

Structure Search

SMILES

[H][C@]12[C@H](C[C@@H](C)C=C1C=C[C@H](C)[C@@H]2CC[C@@H]3CC=CC(=O)O3)OC(=O)[C@@H](C)CC

InChI

InChIKey=SPIVMHAGTHFLMO-OCAGQIGWSA-N

InChI=1S/C24H34O4/c1-5-16(3)24(26)28-21-14-15(2)13-18-10-9-17(4)20(23(18)21)12-11-19-7-6-8-22(25)27-19/h6,8-10,13,15-17,19-21,23H,5,7,11-12,14H2,1-4H3/t15-,16-,17-,19-,20-,21-,23-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C24H34O4
Molecular Weight	386.5244
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	7 / 7
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 18:40:51 GMT 2023` Edited by `admin` on `Sat Dec 16 18:40:51 GMT 2023`
Record UNII	2BW5MV3UB3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(1S,3R,7S,8S,8AR)-3,7-DIMETHYL-8-(2-((2R)-6-OXO-3,6-DIHYDRO-2H-PYRAN-2-YL)ETHYL)-1,2,3,7,8,8A-HEXAHYDRONAPHTHALEN-1-YL (2S)-2-METHYLBUTANOATE

Systematic Name

English

.ALPHA.,.BETA.-DEHYDROLOVASTATIN

Common Name

English

LOVASTATIN IMPURITY C [EP IMPURITY]

Common Name

English

DEHYDROMONACOLIN K

Common Name

English

BUTANOIC ACID, 2-METHYL-, (1S,3R,7S,8S,8AR)-8-(2-((2R)-3,6-DIHYDRO-6-OXO-2H-PYRAN-2-YL)ETHYL)-1,2,3,7,8,8A-HEXAHYDRO-3,7-DIMETHYL-1-NAPHTHALENYL ESTER, (2S)-

Systematic Name

English

L 642257

Common Name

English

DEHYDROLOVASTATIN [EP IMPURITY]

Common Name

English

ANHYDROLOVASTATIN

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID40747447

Created by admin on Sat Dec 16 18:40:52 GMT 2023 , Edited by admin on Sat Dec 16 18:40:52 GMT 2023

PRIMARY

FDA UNII

2BW5MV3UB3

Created by admin on Sat Dec 16 18:40:52 GMT 2023 , Edited by admin on Sat Dec 16 18:40:52 GMT 2023

PRIMARY

CAS

109273-98-5

Created by admin on Sat Dec 16 18:40:52 GMT 2023 , Edited by admin on Sat Dec 16 18:40:52 GMT 2023

PRIMARY

PUBCHEM

71315317

Created by admin on Sat Dec 16 18:40:52 GMT 2023 , Edited by admin on Sat Dec 16 18:40:52 GMT 2023

PRIMARY

Related Record Type Details


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LOVASTATIN

PARENT -> IMPURITY

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

EP

Amount: