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CHEBI:756973 - rencofilstat

Default Structure
ChEBI IDCHEBI:756973
ChEBI Namerencofilstat
Stars
Last Modified30 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC67H122N12O13
Net Charge0
Average Mass1303.784
Monoisotopic Mass1302.92543
SMILES[H][C@]1([C@H](O)[C@H](C)CCCCCCNC(C)=O)C(=O)N[C@@H](CC)C(=O)N(C)[C@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N(C)[C@@H](C(C)C)C(=O)N1C
InChIInChI=1S/C67H122N12O13/c1-26-48-63(88)73(19)46(17)62(87)74(20)50(34-38(4)5)59(84)72-53(41(10)11)66(91)75(21)49(33-37(2)3)58(83)69-44(15)57(82)70-45(16)61(86)76(22)51(35-39(6)7)64(89)77(23)52(36-40(8)9)65(90)78(24)54(42(12)13)67(92)79(25)55(60(85)71-48)56(81)43(14)31-29-27-28-30-32-68-47(18)80/h37-46,48-56,81H,26-36H2,1-25H3,(H,68,80)(H,69,83)(H,70,82)(H,71,85)(H,72,84)/t43-,44+,45-,46-,48+,49+,50+,51+,52+,53+,54+,55+,56-/m1/s1
InChIKeyKBARHGHBFILILC-NGIJKBHDSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
rencofilstat (CHEBI:756973) has role antineoplastic agent (CHEBI:35610)
rencofilstat (CHEBI:756973) is a homodetic cyclic peptide (CHEBI:24613)
INN  Source
rencofilstatWHO MedNet
Synonyms  Source
Cpi-431ChEMBL
Cpi-431-32ChEMBL
CRV-431ChEMBL
CRV431ChEMBL