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Name:CHEMBL370571
PubChem ID:11700170
Pathway:Show KEGG pathways
InChI:InChI=1S/C34H45N5O7/c1-34-12-11-22-21-10-8-20(40)13-18(21)7-9-23(22)24(34)14-19(30(34)44)5-3-2-4-6-26(41)45-15-25-28(42)29(43)33(46-25)39-17-38-27-31(35)36-16-37-32(27)39/h8,10,13,16-17,19,22-25,28-30,33,40,42-44H,2-7,9,11-12,14-15H2,1H3,(H2,35,36,37)/t19?,22?,23?,24?,25-,28-,29-,30+,33-,34+/m1/s1
SMILES:O=C(OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N)CCCCCC1C[C@@H]2[C@]([C@H]1O)(C)CC[C@H]1[C@H]2CCc2c1ccc(c2)O

Properties:
Formula:C34H45N5O7Atoms:46
Molecular Weight:635.75Rotatable Bonds:10
H-bond Acceptors:12H-bond Donors:5
logP:3.9515
Targets:
NameUniprot IDSourceReferencesInteraction
Estradiol 17-beta-dehydrogenase 1DHB1_HUMANBindingDB-shows
Synonyms:
CHEBI:431742
CHEMBL370571
CID 11700170
CID11700170