CHEBI:230486 - mevociclib

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ChEBI Name mevociclib
ChEBI ID CHEBI:230486
Definition Mevociclib (SY-1365) is a selective CDK7 inhibitor. Mevociclib exhibits anti-proliferative and apoptotic effects in solid tumor cell lines. Mevociclib possesses anti-tumor activity in hematological and multiple aggressive solid tumors.
Stars This entity has been manually annotated by a third party.
Submitter Delphine Zhou
Supplier Information
Download Molfile XML SDF
Formula C31H35ClN8O2
Net Charge 0
Average Mass 587.130
Monoisotopic Mass 586.25715
InChI InChI=1S/C31H35ClN8O2/c1-31(39-29(42)26-13-12-21(17-33-26)36-27(41)11-7-15-40(2)3)14-6-8-20(16-31)37-30-35-19-24(32)28(38-30)23-18-34-25-10-5-4-9-22(23)25/h4-5,7,9-13,17-20,34H,6,8,14-16H2,1-3H3,(H,36,41)(H,39,42)(H,35,37,38)/b11-7+/t20-,31+/m1/s1
InChIKey SCJNYBYSTCRPAO-LXBQGUBHSA-N
SMILES O=C(C1=NC=C(NC(/C=C/CN(C)C)=O)C=C1)N[C@@]2(C)CCC[C@@H](NC3=NC=C(Cl)C(C4=CNC5=C4C=CC=C5)=N3)C2
ChEBI Ontology
Outgoing mevociclib (CHEBI:230486) is a organic molecular entity (CHEBI:50860)
Synonym Source
SY-1365 SUBMITTER
Registry Number Type Source
1816989-16-8 CAS Registry Number SUBMITTER