CHRYSCANDIN ,86936-90-5 _Chemical Cloud Database

CHRYSCANDIN

Basic Information
Product Name：	CHRYSCANDIN
CAS：	86936-90-5
English Synonyms：	CHRYSCANDIN
MDL Number.：	MFCD09838094
H bond acceptor：	13
H bond donor：	5
Smile：	COc1ccc(cc1)C[C@@H](C(=O)N[C@H]2[C@H]([C@@H](O[C@@H]2C(=O)O)n3cnc4c3ncnc4N)O)N
InChi：	InChI=1S/C20H23N7O6/c1-32-10-4-2-9(3-5-10)6-11(21)18(29)26-12-14(28)19(33-15(12)20(30)31)27-8-25-13-16(22)23-7-24-17(13)27/h2-5,7-8,11-12,14-15,19,28H,6,21H2,1H3,(H,26,29)(H,30,31)(H2,22,23,24)/t11-,12-,14+,15-,19+/m0/s1
InChiKey：	InChIKey=TXYMIIPGRTXESZ-JDZCFQESSA-N

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