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> Main
CHEBI:16784 - 6β-hydroxy-17β-estradiol
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ChEBI Name
6β-hydroxy-17β-estradiol
ChEBI ID
CHEBI:16784
ChEBI ASCII Name
6beta-hydroxy-17beta-estradiol
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:12238, CHEBI:2242, CHEBI:20762
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Formula
C18H24O3
Net Charge
0
Average Mass
288.38136
Monoisotopic Mass
288.17254
InChI
InChI=1S/C18H24O3/c1-
18-
7-
6-
12-
11-
3-
2-
10(19)
8-
14(11)
16(20)
9-
13(12)
15(18)
4-
5-
17(18)
21/h2-
3,8,12-
13,15-
17,19-
21H,4-
7,9H2,1H3/t12-
,13-
,15+,16-
,17+,18+/m1/s1
InChIKey
QZZRQURPSRWTLG-UXCAXZQLSA-N
SMILES
[H][C@]12CC[C@]3(C)[C@@H](O)CC[C@@]3([H])[C@]1([H])C[C@@H](O)c1cc(O)ccc21
ChEBI Ontology
Outgoing
6β-hydroxy-17β-estradiol (
CHEBI:16784
)
has functional parent
17β-estradiol (
CHEBI:16469
)
6β-hydroxy-17β-estradiol (
CHEBI:16784
)
is a
6β-hydroxy steroid (
CHEBI:36851
)
IUPAC Name
estra-1,3,5(10)-triene-3,6β,17β-triol
Synonyms
Sources
6beta-hydroxyestradiol-17beta
ChEBI
6beta-Hydroxyestradiol-17beta
KEGG COMPOUND
6β-hydroxyestradiol-17β
UniProt
Manual Xrefs
Databases
C03935
KEGG COMPOUND
LMST02010031
LIPID MAPS
View more database links
Last Modified
13 November 2017