(Q105188977)

English

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

group of stereoisomers with the chemical formula C₃₁H₅₂N₂O₃

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Statements

group of stereoisomers

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pregnane steroid

1 reference

pregnane steroid

500.397793524 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₁H₅₂N₂O₃

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canonical SMILES

O=C(OC1C(N(C(=O)C=C(C)C)C)CCC2(C)C1CCC3C4CCC(C(N(C)C)C)C4(C)CCC32)C

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Pachysandra terminalis

1 reference

Studies on the alkaloids of pachysandra terminalis sieb. et zucc. (3). : Systematic separation and characterization of alkaloids.

Identifiers

InChI=1S/C31H52N2O3/c1-19(2)18-28(35)33(9)27-15-17-31(6)25-14-16-30(5)23(20(3)32(7)8)12-13-24(30)22(25)10-11-26(31)29(27)36-21(4)34/h18,20,22-27,29H,10-17H2,1-9H3

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OBEQTYAHIYKMOQ-UHFFFAOYSA-N

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2 references

2 January 2023

based on heuristic

inferred from InChIKey

matched by identifier from

OBEQTYAHIYKMOQ-UHFFFAOYSA-N

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