(Q104888808)

English

(1S)-1-[(3R,8S,9S,10R,13S,14S,17S)-3-methoxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-N,N-dimethylethanamine

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

1-[(8S,9R,10R,13S,14S,17R)-3-methoxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-N,N-dimethylethanamine

1 reference

based on heuristic

inferred from SMILES

1-(3-methoxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl)-N,N-dimethylethanamine

1 reference

based on heuristic

inferred from SMILES

mass

359.318814932 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1S)-1-[(3S,8S,9S,10R,13R,14S,17S)-3-methoxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-N,N-dimethylethanamine

1 reference

based on heuristic

inferred from InChI

[(1S)-1-[(1S,3aS,3bS,7S,9aR,9bS,11aS)-7-methoxy-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9bH,10H,11H-cyclopenta[a]phenanthren-1-yl]ethyl]dimethylamine

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₄H₄₁NO

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canonical SMILES

O(C)C1CC2=CCC3C(CCC4(C)C(CCC34)C(N(C)C)C)C2(C)CC1

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isomeric SMILES

CO[C@@H]1CC[C@@]2(C)C(=CC[C@H]3[C@@H]4CC[C@H]([C@H](C)N(C)C)[C@@]4(C)CC[C@@H]32)C1

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found in taxon

Sarcococca saligna

1 reference

stated in

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

Sarcococca coriacea

1 reference

stated in

Alkaloid C of Sarcococca pruniformis

Identifiers

InChI

InChI=1S/C24H41NO/c1-16(25(4)5)20-9-10-21-19-8-7-17-15-18(26-6)11-13-23(17,2)22(19)12-14-24(20,21)3/h7,16,18-22H,8-15H2,1-6H3/t16-,18+,19-,20+,21-,22-,23-,24+/m0/s1

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InChIKey

ZTNBSFMIFOLVCM-QAKNPMBRSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

ZTNBSFMIFOLVCM-QAKNPMBRSA-N

(Q104888808)

(1S)-1-[(3R,8S,9S,10R,13S,14S,17S)-3-methoxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-N,N-dimethylethanamine

Statements

Identifiers

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