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CHEBI:756781 - etarfolatide

Default Structure
ChEBI IDCHEBI:756781
ChEBI Nameetarfolatide
Stars
Last Modified30 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC29H34N10O11S
Net Charge0
Average Mass730.717
Monoisotopic Mass730.21292
SMILESN[C@@H](CNC(=O)CC[C@@H](NC(=O)c1ccc(NCc2cnc3ncnc(=O)c-3n2)cc1)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CS)C(=O)O
InChIInChI=1S/C29H34N10O11S/c30-16(25(44)38-18(7-21(41)42)26(45)39-19(11-51)29(49)50)10-32-20(40)6-5-17(28(47)48)37-24(43)13-1-3-14(4-2-13)31-8-15-9-33-23-22(36-15)27(46)35-12-34-23/h1-4,9,12,16-19,31,51H,5-8,10-11,30H2,(H,32,40)(H,37,43)(H,38,44)(H,39,45)(H,41,42)(H,47,48)(H,49,50)(H,33,34,35,46)/t16-,17+,18-,19-/m0/s1
InChIKeyYZSIZVRFVQKMJU-RDGPPVDQSA-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)
etarfolatide (CHEBI:756781) has role antineoplastic agent (CHEBI:35610)
etarfolatide (CHEBI:756781) is a polypeptide (CHEBI:15841)
Synonyms  Source
EC-20ChEMBL
EtarfolatideChEMBL