I-AB-MECA ,152918-27-9 _Chemical Cloud Database

I-AB-MECA

Basic Information
Product Name：	I-AB-MECA
CAS：	152918-27-9
English Synonyms：	I-AB-MECA ; 1-[6-[[(4-AMINO-3-IODOPHENYL)METHYL]AMINO]-9H-PURIN-9-YL]-1-DEOXY-N-METHYL-BETA-D-RIBOFURANURONAMIDE ; N6-(4-AMINO-3-IODOBENZYL)-5'-N-METHYLCARBAMOYLADENOSINE ; 3-IODO-4-AMINOBENZYL-5'-N-METHYLCARBOXAMIDOADENOSINE
MDL Number.：	MFCD00671784
H bond acceptor：	11
H bond donor：	5
Smile：	CNC(=O)[C@@H]1[C@H]([C@H]([C@@H](O1)n2cnc3c2ncnc3NCc4ccc(c(c4)I)N)O)O
InChi：	InChI=1S/C18H20IN7O4/c1-21-17(29)14-12(27)13(28)18(30-14)26-7-25-11-15(23-6-24-16(11)26)22-5-8-2-3-10(20)9(19)4-8/h2-4,6-7,12-14,18,27-28H,5,20H2,1H3,(H,21,29)(H,22,23,24)/t12-,13+,14-,18+/m0/s1
InChiKey：	InChIKey=LOGOEBMHHXYBID-MOROJQBDSA-N
Property
Safety information
WGK Germany：	3

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