dacuronium (CHEBI:755185)

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CHEBI:755185 - dacuronium

Formula	C33H58N2O3
Net Charge	+2
Average Mass	530.838
Monoisotopic Mass	530.44365
SMILES	[H][C@@]12CC[C@]3([H])[C@]([H])(CC[C@]4(C)[C@@H](O)[C@@H]([N+]5(C)CCCCC5)C[C@@]34[H])[C@@]1(C)C[C@H]([N+]1(C)CCCCC1)[C@@H](OC(C)=O)C2
InChI	InChI=1S/C33H58N2O3/c1-23(36)38-30-20-24-12-13-25-26(33(24,3)22-29(30)35(5)18-10-7-11-19-35)14-15-32(2)27(25)21-28(31(32)37)34(4)16-8-6-9-17-34/h24-31,37H,6-22H2,1-5H3/q+2/t24-,25+,26-,27-,28-,29-,30-,31-,32-,33-/m0/s1
InChIKey	XQFBAGUGBNQLRT-ZZZJANDJSA-N

ChEBI Ontology

Outgoing Relation(s)
	dacuronium (CHEBI:755185) is a steroid ester (CHEBI:47880)