Details of the Drug

General Information of Drug (ID: DMSOIWV)

Drug Name

HE-3177

Synonyms

HE-3413; Nuclear factor kappa B pathway modulators (inflammatory disorders); Nuclear factor kappa B pathway modulators (inflammatory disorders), Hollis-Eden

Indication

Disease Entry	ICD 11	Status	REF
Inflammation	1A00-CA43.1	Investigative	[1]
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Structure

3D MOL

2D MOL

Chemical Identifiers

Formula: C19H30O4
Canonical SMILES: CC12CCC(CC1=CC(C3C2CCC4(C3CC(C4O)O)C)O)O
InChI: 1S/C19H30O4/c1-18-5-3-11(20)7-10(18)8-14(21)16-12(18)4-6-19(2)13(16)9-15(22)17(19)23/h8,11-17,20-23H,3-7,9H2,1-2H3/t11-,12-,13-,14-,15+,16+,17-,18-,19-/m0/s1
InChIKey: DBJXJRIEZQPLSN-WGNZAZMQSA-N

Cross-matching ID

PubChem CID: 16660877
TTD ID: D0FA2N

References

1	The ChEMBL database in 2017. Nucleic Acids Res. 2017 Jan 4;45(D1):D945-D954.