(Q104666848)

English

N-[(3S,5S,8R,9S,10S,13S,14S,17S)-17-((S)-1-Dimethylamino-ethyl)-10,13-dimethyl-hexadecahydro-cyclopenta[a]phenanthren-3-yl]-acetamide

chemical compound

In more languages

Statements

type of chemical entity

0 references

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

1 reference

based on heuristic

inferred from SMILES

388.345364028 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

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

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₅H₄₄N₂O

0 references

canonical SMILES

CC(=O)NC1CCC2(C)C(CCC3C2CCC2(C)C3CCC2C(C)N(C)C)C1

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isomeric SMILES

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

0 references

Sarcococca saligna

5 references

Pregnane-Type Steroidal Alkaloids ofSarcococca saligna: a New Class of Cholinesterase Inhibitors

Presence of antispasmodic, antidiarrheal, antisecretory, calcium antagonist and acetylcholinesterase inhibitory steroidal alkaloids in Sarcococca saligna.

Steroidal alkaloids from Sarcococca saligna

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

Steroidal alkaloids from Sarcococca saligna

Identifiers

InChI=1S/C25H44N2O/c1-16(27(5)6)21-9-10-22-20-8-7-18-15-19(26-17(2)28)11-13-24(18,3)23(20)12-14-25(21,22)4/h16,18-23H,7-15H2,1-6H3,(H,26,28)/t16-,18-,19-,20-,21+,22-,23-,24-,25+/m0/s1

0 references

AIEKUSBFLBFTIU-MENSBAHOSA-N

0 references

2 references

26 December 2021

matched by identifier from

AIEKUSBFLBFTIU-MENSBAHOSA-N

mapping relation type

1 reference

matched by identifier from

International Chemical Identifier

InChI=1S/C25H44N2O/c1-16(27(5)6)21-9-10-22-20-8-7-18-15-19(26-17(2)28)11-13-24(18,3)23(20)12-14-25(21,22)4/h16,18-23H,7-15H2,1-6H3,(H,26,28)/t16-,18-,19-,20-,21+,22-,23-,24-,25+/m0/s1

UniChem compound ID

1 reference

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