tern-101 (CHEBI:755872)

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CHEBI:755872 - tern-101

Formula	C28H27Cl2N3O4
Net Charge	0
Average Mass	540.447
Monoisotopic Mass	539.13786
SMILES	Cn1cc(C(=O)O)c2ccc(N3CCC(OCc4c(-c5c(Cl)cccc5Cl)noc4C4CC4)CC3)cc21
InChI	InChI=1S/C28H27Cl2N3O4/c1-32-14-20(28(34)35)19-8-7-17(13-24(19)32)33-11-9-18(10-12-33)36-15-21-26(31-37-27(21)16-5-6-16)25-22(29)3-2-4-23(25)30/h2-4,7-8,13-14,16,18H,5-6,9-12,15H2,1H3,(H,34,35)
InChIKey	RPVDFHPBGBMWID-UHFFFAOYSA-N

Roles Classification

Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base).

ChEBI Ontology

Outgoing Relation(s)
	tern-101 (CHEBI:755872) is a indolyl carboxylic acid (CHEBI:46867)

Citations