DEHYDROEMETINE ,4914-30-1 _Chemical Cloud Database

DEHYDROEMETINE

Basic Information
Product Name：	DEHYDROEMETINE
CAS：	4914-30-1
English Synonyms：	DEHYDROEMETINE
MDL Number.：	MFCD01729551
H bond acceptor：	6
H bond donor：	1
Smile：	CCC1=C(C[C@H]2c3cc(c(cc3CCN2C1)OC)OC)C[C@@H]4c5cc(c(cc5CCN4)OC)OC
InChi：	InChI=1S/C29H38N2O4/c1-6-18-17-31-10-8-20-14-27(33-3)29(35-5)16-23(20)25(31)12-21(18)11-24-22-15-28(34-4)26(32-2)13-19(22)7-9-30-24/h13-16,24-25,30H,6-12,17H2,1-5H3/t24-,25+/m1/s1
InChiKey：	InChIKey=XXLZPUYGHQWHRN-RPBOFIJWSA-N

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