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CHEBI:52167 - hydrabamine dihydrochloride

ChEBI IDCHEBI:52167
ChEBI Namehydrabamine dihydrochloride
Stars
Last Modified18 March 2009
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC42H64N2.2HCl
Net Charge0
Average Mass669.910
Monoisotopic Mass668.46031
SMILESCl.Cl.[H][C@@]12CCc3cc(C(C)C)ccc3[C@@]1(C)CCC[C@@]2(C)CNCCNC[C@]1(C)CCC[C@]2(C)c3ccc(C(C)C)cc3CC[C@@]12[H]
InChIInChI=1S/C42H64N2.2ClH/c1-29(2)31-11-15-35-33(25-31)13-17-37-39(5,19-9-21-41(35,37)7)27-43-23-24-44-28-40(6)20-10-22-42(8)36-16-12-32(30(3)4)26-34(36)14-18-38(40)42;;/h11-12,15-16,25-26,29-30,37-38,43-44H,9-10,13-14,17-24,27-28H2,1-8H3;2*1H/t37-,38-,39-,40-,41+,42+;;/m0../s1
InChIKeyFBGKIVBTDNVGQM-XFRAEFFKSA-N
ChEBI Ontology
Outgoing Relation(s)
hydrabamine dihydrochloride (CHEBI:52167) has part hydrabamine (CHEBI:52166)
hydrabamine dihydrochloride (CHEBI:52167) is a hydrochloride (CHEBI:36807)
IUPAC Name 
N,N'-di[abieta-8(14),9(11),12-trien-18-yl]ethane-1,2-diamine dihydrochloride
Registry NumbersSources
Beilstein:3847468Beilstein
CAS:63087-59-2ChemIDplus