(Q104250376)

English

1-(2,4-diphenyl-3-{3-[(2R)-piperidin-2-yl]-5,6-dihydro-4H-pyridine-1-carbonyl}cyclobutanecarbonyl)-3-[(2R)-piperidin-2-yl]-5,6-dihydro-4H-pyridine

chemical compound

In more languages

Statements

type of chemical entity

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piperidine alkaloids

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592.377726776 dalton

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based on heuristic

inferred from SMILES

stereoisomer of

(-)-Santiaguine

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₈H₄₈N₄O₂

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canonical SMILES

O=C(N1C=C(CCC1)C2NCCCC2)C3C(C=4C=CC=CC4)C(C(=O)N5C=C(CCC5)C6NCCCC6)C3C=7C=CC=CC7

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isomeric SMILES

O=C(C1C(c2ccccc2)C(C(=O)N2C=C([C@H]3CCCCN3)CCC2)C1c1ccccc1)N1C=C([C@H]2CCCCN2)CCC1

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1 reference

Alkaloid-Bearing Plants and Their Contained Alkaloids. 1957-1968

Identifiers

InChI=1S/C38H48N4O2/c43-37(41-23-11-17-29(25-41)31-19-7-9-21-39-31)35-33(27-13-3-1-4-14-27)36(34(35)28-15-5-2-6-16-28)38(44)42-24-12-18-30(26-42)32-20-8-10-22-40-32/h1-6,13-16,25-26,31-36,39-40H,7-12,17-24H2/t31-,32-,33?,34?,35?,36?/m1/s1

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OHNNTQXKHRISJP-AAGWKZJCSA-N

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1 reference

17 September 2022

based on heuristic

inferred from InChIKey

UniChem compound ID

1 reference

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