ALTERNATIVE DEFINITION for [NORGESTIMATE]

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H31NO3
Molecular Weight	369.4971
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of ALTERNATIVE DEFINITION for [NORGESTIMATE]

Structure Search

SMILES

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

InChI

InChIKey=KIQQMECNKUGGKA-NPUFKNHTSA-N

InChI=1S/C23H31NO3/c1-4-22-12-10-19-18-9-7-17(24-26)14-16(18)6-8-20(19)21(22)11-13-23(22,5-2)27-15(3)25/h2,14,18-21,26H,4,6-13H2,1,3H3/b24-17-/t18-,19+,20+,21-,22-,23-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C23H31NO3
Molecular Weight	369.4971
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 18:43:35 GMT 2023` Edited by `admin` on `Sat Dec 16 18:43:35 GMT 2023`
Record UNII	C291HFX4DY
Record Status	`alternative`
Record Version

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					C291HFX4DY

NORGESTIMATE

Related Record Type Details


					C291HFX4DY

NORGESTIMATE

Primary Definition