Bioactive Compound Details

BioIDbio199625
NameNone
ChEMBL IDCHEMBL2017490
Molecular FormulaC35H34N2O5
Molecular Weight562.67
Molecular Weight (Monoisotopic)562.2468
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2'-Nortiliacorinine
SmilesCOc1ccc2cc1-c1cc(ccc1O)C[C@@H]1NCCc3cc4c(cc31)Oc1c(c(OC)cc3c1[C@H](C2)N(C)CC3)O4
InchiInChI=1S/C35H34N2O5/c1-37-11-9-22-17-32(40-3)34-35-33(22)27(37)15-20-5-7-29(39-2)25(13-20)24-12-19(4-6-28(24)38)14-26-23-18-31(42-35)30(41-34)16-21(23)8-10-36-26/h4-7,12-13,16-18,26-27,36,38H,8-11,14-15H2,1-3H3/t26-,27-/m0/s1
Inchi KeyDOUULZLWVARYRD-SVBPBHIXSA-N
Molecular SpeciesBASE
Targets2.0
Bioactivities10.0
Np Likeness Score1.73
Records Key['2']
Records Name[2'-nortiliacorinine"]"
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure