deldeprevir (CHEBI:755100)

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CHEBI:755100 - deldeprevir

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ChEBI ID	CHEBI:755100
ChEBI Name	deldeprevir
Stars
Last Modified	29 June 2026
Submitter	ChEMBL
Downloads	Molfile

Formula	C45H56F2N6O8S2
Net Charge	0
Average Mass	911.107
Monoisotopic Mass	910.35691
SMILES	[H][C@]1(Oc2cc(-c3nc(C(C)C)cs3)nc3c(C)c(OC)ccc23)CN2C(=O)[C@@]([H])(CC(=O)N3CCCC(F)(F)C3)CCCCC/C=C\[C@]3([H])C[C@@]3(C(=O)NS(=O)(=O)C3CC3)NC(=O)[C@]2([H])C1
InChI	InChI=1S/C45H56F2N6O8S2/c1-26(2)34-24-62-41(49-34)33-21-37(32-15-16-36(60-4)27(3)39(32)48-33)61-30-20-35-40(55)50-45(43(57)51-63(58,59)31-13-14-31)22-29(45)12-9-7-5-6-8-11-28(42(56)53(35)23-30)19-38(54)52-18-10-17-44(46,47)25-52/h9,12,15-16,21,24,26,28-31,35H,5-8,10-11,13-14,17-20,22-23,25H2,1-4H3,(H,50,55)(H,51,57)/b12-9-/t28-,29-,30-,35+,45-/m1/s1
InChIKey	UDMJANYPQWEDFT-ZAWFUYGJSA-N

Roles Classification

Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid).

ChEBI Ontology

Outgoing Relation(s)
	deldeprevir (CHEBI:755100) is a dipeptide (CHEBI:46761)

INN	Source
deldeprevir	WHO MedNet

Synonyms	Source
ACH-0142684	ChEMBL
ACH-2684	ChEMBL
Neceprevir	ChEMBL

Citations