ChemicalBook--->CAS DataBase List--->178762-28-2

178762-28-2

178762-28-2 Structure

178762-28-2 Structure
IdentificationBack Directory
[Name]

quinoline-3,8-diol
[CAS]

178762-28-2
[Synonyms]

jineol
3,8-Quinolinediol
quinoline-3,8-diol
[Molecular Formula]

C9H7NO2
[MDL Number]

MFCD18414290
[MOL File]

178762-28-2.mol
[Molecular Weight]

161.16
Chemical PropertiesBack Directory
[Boiling point ]

397.2±22.0 °C(Predicted)
[density ]

1.418±0.06 g/cm3(Predicted)
[form ]

Solid
[pka]

7.74±0.40(Predicted)
[color ]

Off-white to pink
[InChI]

InChI=1S/C9H7NO2/c11-7-4-6-2-1-3-8(12)9(6)10-5-7/h1-5,11-12H
[InChIKey]

IGDFDIZIHMFYGR-UHFFFAOYSA-N
[SMILES]

N1C2C(=CC=CC=2O)C=C(O)C=1
Safety DataBack Directory
[Symbol(GHS) ]


GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P362-P403+P233-P501
Hazard InformationBack Directory
[Uses]

Jineol is a cytotoxic alkaloid from the centipede Scolopendra subspinipes. Jineol exhibits modest cytotoxic activity in vitro against the growth of human tumor cell lines[1].
[Definition]

ChEBI:Jineol is a dihydroxyquinoline that is quinoline substituted by hydroxy groups at positions 3 and 8. Isolated from the centipede Scolopendra subspinipes, it exhibits cytotoxic activity against human tumour cell lines. It has a role as a metabolite and an antineoplastic agent. It is a quinoline alkaloid, a member of quinolines and a dihydroxyquinoline.
[References]

[1] Surk-Sik Moon, et al. Jineol, a Cytotoxic Alkaloid from the Centipede Scolopendra subspinipes.
Spectrum DetailBack Directory
[Spectrum Detail]

quinoline-3,8-diol(178762-28-2)1HNMR
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