(Q27210089)

MLS000042259 (English)

11 October 2016

chemical formula

C₂₈H₂₆N₄O₃

1 reference

MLS000042259 (English)

11 October 2016

canonical SMILES

C1CN2C(CN1C3=CC=CC=C3)C4(CC5=CC=CC=C52)C(=O)NC(=O)N(C4=O)CC6=CC=CC=C6

1 reference

MLS000042259 (English)

11 October 2016

isomeric SMILES

C1CN2C(CN1C3=CC=CC=C3)[C@]4(CC5=CC=CC=C52)C(=O)NC(=O)N(C4=O)CC6=CC=CC=C6

1 reference

MLS000042259 (English)

InChI=1S/C28H26N4O3/c33-25-28(26(34)32(27(35)29-25)18-20-9-3-1-4-10-20)17-21-11-7-8-14-23(21)31-16-15-30(19-24(28)31)22-12-5-2-6-13-22/h1-14,24H,15-19H2,(H,29,33,35)/t24?,28-/m1/s1

11 October 2016

Identifiers

InChI

1 reference

MLS000042259 (English)

BEXWSKNRHHXTRK-ITCMONMYSA-N

11 October 2016

InChIKey

2 references

MLS000042259 (English)

11 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(5R)-1'-Benzyl-3-phenyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione (English)

11 October 2016

1 reference

(5R)-1'-Benzyl-3-phenyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione (English)

11 October 2016

1 reference

MLS000042259 (English)

11 October 2016

ChEBI ID

121533

mapping relation type

1 reference

(5R)-3'-phenyl-1-(phenylmethyl)spiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-2,4,6-trione (English)

11 October 2016

1 reference