(1R,8aα,9S)-6β-[(Dimethylamino)methyl]-1,5a,6,7,8,8a-hexahydro-5aα-methyl-9-isopropyl-1,4α-methano-2H-cyclopent[d]oxepine-2,5(4H)-dione

(1R,8aα,9S)-6β-[(Dimethylamino)methyl]-1,5a,6,7,8,8a-hexahydro-5aα-methyl-9-isopropyl-1,4α-methano-2H-cyclopent[d]oxepine-2,5(4H)-dione 구조식 이미지
카스 번호:
4684-24-6
상품명:
(1R,8aα,9S)-6β-[(Dimethylamino)methyl]-1,5a,6,7,8,8a-hexahydro-5aα-methyl-9-isopropyl-1,4α-methano-2H-cyclopent[d]oxepine-2,5(4H)-dione
동의어(영문):
Nobiline;2,5-Methano-2H-cyclopent[d]oxepin-1,4-dione, 8-[(dimethylamino)methyl]hexahydro-8a-methyl-9-(1-methylethyl)-, (2R,5R,5aS,8S,8aR,9S)-;(1R,8aα,9S)-6β-[(Dimethylamino)methyl]-1,5a,6,7,8,8a-hexahydro-5aα-methyl-9-isopropyl-1,4α-methano-2H-cyclopent[d]oxepine-2,5(4H)-dione
CBNumber:
CB12284375
분자식:
C17H27NO3
포뮬러 무게:
293.4
MOL 파일:
4684-24-6.mol

(1R,8aα,9S)-6β-[(Dimethylamino)methyl]-1,5a,6,7,8,8a-hexahydro-5aα-methyl-9-isopropyl-1,4α-methano-2H-cyclopent[d]oxepine-2,5(4H)-dione 속성

녹는점
87-8°C
끓는 점
421.7±20.0 °C(Predicted)
밀도
1.089±0.06 g/cm3(Predicted)
산도 계수 (pKa)
9.26±0.28(Predicted)

안전

(1R,8aα,9S)-6β-[(Dimethylamino)methyl]-1,5a,6,7,8,8a-hexahydro-5aα-methyl-9-isopropyl-1,4α-methano-2H-cyclopent[d]oxepine-2,5(4H)-dione C화학적 특성, 용도, 생산

개요

Present in Dendrobiurn nobile, this alkaloid forms colourless crystals from MeOH. It yields a crystalline hydrochloride, m.p. 206-8°C and the methiodide, m.p. 275-6°C. Treatment of the free base with alcoholic KOH followed by HCI gives isonobiline hydrochloride, m.p. l83-5°C. LiAIH4 furnishes an amorphous tril whereas NaBH4 in tetrahydrofuran gives the amorphous hydroxynobiline which is converted into hydroxyisonobiline, m.p. 217 -9°C under the same conditions as given above for the alkaloid. Hofmann degradation of nobiline methiodide yields trimethylamine and deaminonobiline, m.p. l79-183°C. The structure given above for the alkaloid has been suggested on the basis of these chemical reactions and spectroscopic evidence.

참고 문헌

Yamamura, Hirata., Tetrahedron Lett., 79 (1964)

(1R,8aα,9S)-6β-[(Dimethylamino)methyl]-1,5a,6,7,8,8a-hexahydro-5aα-methyl-9-isopropyl-1,4α-methano-2H-cyclopent[d]oxepine-2,5(4H)-dione 준비 용품 및 원자재

원자재

준비 용품


(1R,8aα,9S)-6β-[(Dimethylamino)methyl]-1,5a,6,7,8,8a-hexahydro-5aα-methyl-9-isopropyl-1,4α-methano-2H-cyclopent[d]oxepine-2,5(4H)-dione 공급 업체

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