HEMATIN ,15489-90-4 _Chemical Cloud Database

HEMATIN

Basic Information
Product Name：	HEMATIN
CAS：	15489-90-4
English Synonyms：	HEMATIN ; BOVINE HEMIN ; HEMATEIN ; HYDROXYHEMIN ; HEMATIN PORCINE ; HAEMATIN
MDL Number.：	MFCD00011615
H bond acceptor：	9
H bond donor：	3
Smile：	Cc1/c/2c/c3n/c(c\c4c(c(c/5n4[Fe](n2/c(/c1CCC(=O)O)c\c6n/c(c5)/C(=C6CCC(=O)O)C)O)C=C)C)/C(=C3C)C=C
InChi：	InChI=1S/C34H34N4O4.Fe.H2O/c1-7-21-17(3)25-13-26-19(5)23(9-11-33(39)40)31(37-26)16-32-24(10-12-34(41)42)20(6)28(38-32)15-30-22(8-2)18(4)27(36-30)14-29(21)35-25;;/h7-8,13-16H,1-2,9-12H2,3-6H3,(H4,35,36,37,38,39,40,41,42);;1H2/q;+3;/p-3/b25-13-,26-13-,27-14-,28-15-,29-14-,30-15-,31-16-,32-16-;;
InChiKey：	InChIKey=BMUDPLZKKRQECS-HXFTUNQESA-K
Property
Comments：	EINECS: 239-518-9 MERCK: 14,4635 RTECS: NO6725000 TSCA: N UNSPSC: 12352005
Safety information
WGK Germany：	3

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