Isopregnanolone

01Tożsamość

Lazychem ID	LC-118260
CAS RN	Nie podano
PubChem CID	92787
Molecular formula	C21H34O2
Molecular weight	318.5 g/mol
IUPAC name	1-[(3S,5S,8R,9S,10S,13S,14S,17S)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone
InChIKey	AURFZBICLPNKBZ-FZCSVUEKSA-N

02Struktura i stereochemia

Two-dimensional chemical structure of Isopregnanolone — Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

SMILES	CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CC[C@@H](C4)O)C)C
InChI	Nie podano

03Stereochemistry

The published structure contains 8 defined and 0 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres8Structure assigned

Unassigned centres0Structure unspecified

Assignment statusFully assignedExact published identity

Tetrahedral upper bound≤ 256Before symmetry reduction

Published same-connectivity configurations

2 records

These records have the same connectivity, molecular formula and protonation layer, but a different complete InChIKey stereochemical layer. Only separately structure-linked records are shown.

CAS not listed

AURFZBICLPNKBZ-FZCSVUEKSA-N

Current configuration

Allopregnanolone

CAS 516-54-1

AURFZBICLPNKBZ-SYBPFIFISA-N

8 defined, 0 unassigned centres

Scope: The mathematical 2^n value is only an upper bound. Symmetry and other stereogenic elements can change the number of distinct stereoisomers. A hypothetical configuration is not published as a compound record without a verified structure identity.

04Status w Indiach

Exact-compound status is evaluated only against the published name and CAS number. Confirm the current official instrument before a regulatory decision.

Isopregnanolone

01Tożsamość

02Struktura i stereochemia

03Stereochemistry

Published same-connectivity configurations