Neoeuonymine

neoeuonymine

https://huagongshe.com/ko/chemical/477608

식별자 및 물리적 특성

CAS No.	33510-25-7
분자식	C36H45NO17
평균 분자량	763.7 g/mol
단동위원소 질량	763.26874897 g/mol
SMILES	CC(=O)OC[C@]12[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]3[C@@H](O)[C@@]14O[C@@]3(C)COC(=O)c1cccnc1[C@@H](C)[C@H](C)C(=O)O[C@@H]([C@H](OC(C)=O)[C@@H]2OC(C)=O)C4(C)O
InChIKey	NKTOESKXBIEREY-RRFKVAGVSA-N
PubChem CID	477608
ChEMBL	CHEMBL499170

화학 및 물리적 성질

XLogP	-0.1
극성 표면적	247
수소 결합 공여자 수	2
수소 결합 수용자 수	18
회전 가능 결합 수	11
무거운 원자 수	54
형식 전하	0
복잡도	1,570
녹는점	2S9-262°C
InChIKey	NKTOESKXBIEREY-RRFKVAGVSA-N

용도

개요

A macrocyclic alkaloid occurring in Euonymus sieboldiana Blume, the base yields colourless crystals from MeOH. It is laevorotatory with [α]D - 11° (c 0.49, CHCI3). The ultraviolet spectrum has two absorption maxima at 228 and 266 mJi. Four acetoxy groups and one acetoxymethyl group are present together with one secondary and one tertiary hydroxyl group. The structure has been elucidated from spectroscopic investigations, particularly the NMR and mass spectra.