(Q105181480)

English

(3S,8R,9S,10S,13S,14S,17S)-17-[(1S)-1-(dimethylamino)ethyl]-N,10,13-trimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-amine

group of stereoisomers with the chemical formula C₂₄H₄₄N₂

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Statements

instance of

group of stereoisomers

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subclass of

(1S,3bR,9aS,11aS)-1-[1-(dimethylamino)ethyl]-N,9a,11a-trimethyl-tetradecahydro-1H-cyclopenta[a]phenanthren-7-amine

1 reference

based on heuristic

inferred from SMILES

mass

360.350449408 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₄H₄₄N₂

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canonical SMILES

N(C)C1CCC2(C)C(CCC3C4CCC(C(N(C)C)C)C4(C)CCC32)C1

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isomeric SMILES

CN[C@H]1CC[C@@]2(C)C(CC[C@@H]3[C@@H]2CC[C@]2(C)[C@@H]([C@H](C)N(C)C)CC[C@@H]32)C1

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found in taxon

Sarcococca saligna

1 reference

stated in

3D-QSAR studies on natural acetylcholinesterase inhibitors of Sarcococca saligna by comparative molecular field analysis (CoMFA)

Identifiers

InChI

InChI=1S/C24H44N2/c1-16(26(5)6)20-9-10-21-19-8-7-17-15-18(25-4)11-13-23(17,2)22(19)12-14-24(20,21)3/h16-22,25H,7-15H2,1-6H3/t16-,17?,18-,19-,20+,21-,22-,23-,24+/m0/s1

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InChIKey

NLOJUKSOUNWUSW-NUOWXSDFSA-N

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1 reference

17 September 2022

inferred from InChIKey

1 reference

(Q105181480)

(3S,8R,9S,10S,13S,14S,17S)-17-[(1S)-1-(dimethylamino)ethyl]-N,10,13-trimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-amine

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Identifiers

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