16.ALPHA.-LE2

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H24O4
Molecular Weight	328.4022
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C[C@]12CC[C@H]3[C@@H](CCC4=CC(O)=CC=C34)[C@@H]1C[C@H]5OC(=O)C[C@@]25O

InChI

InChIKey=NLUGVTJBNRSIKH-UQZPWQSVSA-N

InChI=1S/C20H24O4/c1-19-7-6-14-13-5-3-12(21)8-11(13)2-4-15(14)16(19)9-17-20(19,23)10-18(22)24-17/h3,5,8,14-17,21,23H,2,4,6-7,9-10H2,1H3/t14-,15-,16+,17-,19+,20+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C20H24O4
Molecular Weight	328.4022
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 09:14:55 GMT 2025` Edited by `admin` on `Wed Apr 02 09:14:55 GMT 2025`
Record UNII	Z7DNN9U8AE
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

16.ALPHA.-LE2

Common Name

English

ZK-281471

Preferred Name

English

19-NORPREGNA-1,3,5(10)-TRIEN-21-OIC ACID, 3,16,17-TRIHYDROXY-, .GAMMA.-LACTONE, (16.ALPHA.,17.ALPHA.)-

Systematic Name

English

3,17.BETA.-DIHYDROXY-19-NOR-17.ALPHA.-PREGNA-1,3,5(10)-TRIENE-21,16.ALPHA.-LACTONE

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID401047811