(Q27187855)

English

N-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-pyridinecarboxamide

chemical compound

In more languages

Statements

type of chemical entity

0 references

chemical compound

0 references

592.305±0 dalton

1 reference

language of work or name

BRD-K34318928-001-01-8 (English)

10 October 2016

stereoisomer of

N-[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-pyridinecarboxamide

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

N-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-pyridinecarboxamide

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

N-[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-pyridinecarboxamide

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

N-[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-pyridinecarboxamide

1 reference

based on heuristic

inferred from InChI

N-[(2S,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-pyridinecarboxamide

1 reference

based on heuristic

inferred from InChI

N-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-pyridinecarboxamide

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₆H₄₀N₄O₄

1 reference

language of work or name

BRD-K34318928-001-01-8 (English)

10 October 2016

canonical SMILES

CC1CN(C(=O)CC2=C(C=CC(=C2)NC(=O)C3=CC=NC=C3)OC1CN(C)CC4=CC=C(C=C4)C5=CC=CC=C5)C(C)CO

1 reference

language of work or name

BRD-K34318928-001-01-8 (English)

10 October 2016

isomeric SMILES

C[C@H]1CN(C(=O)CC2=C(C=CC(=C2)NC(=O)C3=CC=NC=C3)O[C@@H]1CN(C)CC4=CC=C(C=C4)C5=CC=CC=C5)[C@@H](C)CO

1 reference

language of work or name

BRD-K34318928-001-01-8 (English)

10 October 2016

Identifiers

InChI=1S/C36H40N4O4/c1-25-21-40(26(2)24-41)35(42)20-31-19-32(38-36(43)30-15-17-37-18-16-30)13-14-33(31)44-34(25)23-39(3)22-27-9-11-29(12-10-27)28-7-5-4-6-8-28/h4-19,25-26,34,41H,20-24H2,1-3H3,(H,38,43)/t25-,26-,34+/m0/s1

1 reference

language of work or name

BRD-K34318928-001-01-8 (English)

10 October 2016

IQSVNIDGIMJPQN-XIWHWFKQSA-N

2 references

language of work or name

BRD-K34318928-001-01-8 (English)

10 October 2016

ChEBI release 2020-09-01

2 references

language of work or name

BRD-K34318928-001-01-8 (English)

10 October 2016

matched by identifier from

IQSVNIDGIMJPQN-XIWHWFKQSA-N

mapping relation type

1 reference

language of work or name

N-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-pyridinecarboxamide (English)

10 October 2016

UniChem compound ID

1 reference

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