ALTERNATIVE DEFINITION for [NORELGESTROMIN]

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H29NO2
Molecular Weight	327.4605
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of ALTERNATIVE DEFINITION for [NORELGESTROMIN]

Structure Search

SMILES

[H][C@@]12CC[C@@](O)(C#C)[C@@]1(CC)CC[C@]3([H])[C@@]4([H])CCC(C=C4CC[C@@]23[H])=NO

InChI

InChIKey=ISHXLNHNDMZNMC-UGCMNZCRSA-N

InChI=1S/C21H29NO2/c1-3-20-11-9-17-16-8-6-15(22-24)13-14(16)5-7-18(17)19(20)10-12-21(20,23)4-2/h2,13,16-19,23-24H,3,5-12H2,1H3/b22-15-/t16-,17+,18+,19-,20-,21-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C21H29NO2
Molecular Weight	327.4605
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 18:57:38 GMT 2023` Edited by `admin` on `Sat Dec 16 18:57:38 GMT 2023`
Record UNII	R0TAY3X631
Record Status	`alternative`
Record Version

Download


					R0TAY3X631

NORELGESTROMIN

Related Record Type Details


					R0TAY3X631

NORELGESTROMIN

Primary Definition