2-Nitroestra-1,3,5(10)-triene-3,17beta-diol (CHEBI:79530)

CHEBI:79530 - 2-Nitroestra-1,3,5(10)-triene-3,17beta-diol

Formula	C18H23NO4
Net Charge	0
Average Mass	317.385
Monoisotopic Mass	317.16271
SMILES	[H][C@@]12CCc3cc(O)c([N+](=O)[O-])cc3[C@@]1([H])CC[C@]1(C)[C@@H](O)CC[C@@]21[H]
InChI	InChI=1S/C18H23NO4/c1-18-7-6-11-12(14(18)4-5-17(18)21)3-2-10-8-16(20)15(19(22)23)9-13(10)11/h8-9,11-12,14,17,20-21H,2-7H2,1H3/t11-,12+,14-,17-,18-/m0/s1
InChIKey	GWIXIEVQSOLTQI-XSSYPUMDSA-N

ChEBI Ontology

Outgoing Relation(s)
	2-Nitroestra-1,3,5(10)-triene-3,17beta-diol (CHEBI:79530) is a 3-hydroxy steroid (CHEBI:36834)

Synonym	Source
2-Nitroestradiol	KEGG COMPOUND

Manual Xrefs	Databases
C15007	KEGG COMPOUND