(Q104922504)

English

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

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

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

1 reference

based on heuristic

inferred from SMILES

mass

331.287514804 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

3alpha-(Methylamino)-5alpha-pregnane-20-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₂H₃₇NO

0 references

canonical SMILES

O=C(C)C1CCC2C3CCC4CC(NC)CCC4(C)C3CCC12C

0 references

isomeric SMILES

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

0 references

found in taxon

Holarrhena pubescens

1 reference

stated in

Alcaloïdes des feuilles de Holarrhena febrifuga

Sarcococca coriacea

1 reference

stated in

New cholinesterase inhibiting steroidal alkaloids from the leaves of Sarcococca coriacea of Nepalese origin

Identifiers

InChI

InChI=1S/C22H37NO/c1-14(24)18-7-8-19-17-6-5-15-13-16(23-4)9-11-21(15,2)20(17)10-12-22(18,19)3/h15-20,23H,5-13H2,1-4H3/t15-,16+,17-,18+,19-,20-,21-,22-/m0/s1

0 references

InChIKey

BAWXWUZBFYSEDR-BORIEPGUSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

BAWXWUZBFYSEDR-BORIEPGUSA-N

(Q104922504)

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

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Identifiers

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