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CHEBI:748996 - tt-232

Default Structure
ChEBI IDCHEBI:748996
ChEBI Namett-232
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC45H58N10O9S2
Net Charge0
Average Mass947.154
Monoisotopic Mass946.38297
SMILES[H][C@]1(NC(=O)[C@H](N)Cc2ccccc2)CSSC[C@@]([H])(C(=O)N[C@]([H])(C(N)=O)[C@@H](C)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2cnc3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O
InChIInChI=1S/C45H58N10O9S2/c1-25(56)38(39(48)58)55-45(64)37-24-66-65-23-36(53-40(59)31(47)19-26-9-3-2-4-10-26)44(63)51-34(20-27-14-16-29(57)17-15-27)42(61)52-35(21-28-22-49-32-12-6-5-11-30(28)32)43(62)50-33(41(60)54-37)13-7-8-18-46/h2-6,9-12,14-17,22,25,31,33-38,49,56-57H,7-8,13,18-21,23-24,46-47H2,1H3,(H2,48,58)(H,50,62)(H,51,63)(H,52,61)(H,53,59)(H,54,60)(H,55,64)/t25-,31-,33+,34+,35-,36+,37+,38+/m1/s1
InChIKeySNAJPQVDGYDQSW-DYCFWDQMSA-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)
tt-232 (CHEBI:748996) has role antineoplastic agent (CHEBI:35610)
tt-232 (CHEBI:748996) is a polypeptide (CHEBI:15841)
Synonyms  Source
TLN-232ChEMBL
Tt-232ChEMBL
Citations