ALMITRINE-RAUBASINE ,76997-30-3 _Chemical Cloud Database

ALMITRINE-RAUBASINE

Basic Information
Product Name：	ALMITRINE-RAUBASINE
CAS：	76997-30-3
English Synonyms：	ALMITRINE-RAUBASINE
MDL Number.：	MFCD16621042
H bond acceptor：	7
H bond donor：	2
Smile：	C[C@H]1[C@H]2CN3CCc4c5ccccc5[nH]c4[C@@H]3C[C@@H]2C(=CO1)C(=O)OC.C=CCNc1nc(nc(n1)N2CCN(CC2)C(c3ccc(cc3)F)c4ccc(cc4)F)NCC=C
InChi：	InChI=1S/C26H29F2N7.C21H24N2O3/c1-3-13-29-24-31-25(30-14-4-2)33-26(32-24)35-17-15-34(16-18-35)23(19-5-9-21(27)10-6-19)20-7-11-22(28)12-8-20;1-12-16-10-23-8-7-14-13-5-3-4-6-18(13)22-20(14)19(23)9-15(16)17(11-26-12)21(24)25-2/h3-12,23H,1-2,13-18H2,(H2,29,30,31,32,33);3-6,11-12,15-16,19,22H,7-10H2,1-2H3/t;12-,15-,16+,19-/m.0/s1
InChiKey：	InChIKey=LWKZCNVWFBSPKH-FVLLGJNOSA-N

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