Pleiocarpine (Q15425258)

Pleiocarpine (English)

21 September 2016

chemical formula

C₂₃H₂₈N₂O₄

1 reference

Pleiocarpine (English)

21 September 2016

canonical SMILES

COC(=O)C1CC23CCCN4C2C5(C1(CC3)N(C6=CC=CC=C65)C(=O)OC)CC4

1 reference

Pleiocarpine (English)

21 September 2016

isomeric SMILES

COC(=O)[C@@H]1CC23CCCN4[C@@H]2[C@@]5(C1(CC3)N(C6=CC=CC=C65)C(=O)OC)CC4

1 reference

Pleiocarpine (English)

InChI=1S/C23H28N2O4/c1-28-18(26)16-14-21-8-5-12-24-13-11-22(19(21)24)15-6-3-4-7-17(15)25(20(27)29-2)23(16,22)10-9-21/h3-4,6-7,16,19H,5,8-14H2,1-2H3/t16-,19-,21?,22+,23?/m0/s1

21 September 2016

Identifiers

InChI

1 reference

Pleiocarpine (English)

SQVLFJQJOPEBAA-AUEHJUDRSA-N

21 September 2016

InChIKey

1 reference

Pleiocarpine (English)

21 September 2016

1 reference

Dimethyl (3beta)-aspidofractinine-1,3-dicarboxylate (English)

21 September 2016

1 reference

Pleiocarpine (English)

21 September 2016

ChEBI ID

141940

mapping relation type

0 references

1 reference