Bioactive Compound Details

BioIDbio198542
Name3BETA,20BETA-DIHYDROXY-16ALPHA-(2-METHOXY ETHOXY)-PREGN-5-EN
ChEMBL IDCHEMBL2261226
Molecular FormulaC24H40O4
Molecular Weight392.58
Molecular Weight (Monoisotopic)392.2927
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
SynonymsNone
SmilesCOCCO[C@@H]1C[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]2(C)[C@H]1[C@H](C)O
InchiInChI=1S/C24H40O4/c1-15(25)22-21(28-12-11-27-4)14-20-18-6-5-16-13-17(26)7-9-23(16,2)19(18)8-10-24(20,22)3/h5,15,17-22,25-26H,6-14H2,1-4H3/t15-,17-,18+,19-,20-,21+,22-,23-,24-/m0/s1
Inchi KeyUESTZPINGWOTMQ-VMMTXMNJSA-N
Molecular SpeciesNEUTRAL
Targets3.0
Bioactivities11.0
Np Likeness Score2.26
Records Key['12']
Records Name['3beta,20beta-Dihydroxy-16alpha-(2-methoxy ethoxy)-pregn-5-en']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure