(16R)-3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-16,17-diol (Q27163718)

Estriol methyl ether (English)

9 October 2016

chemical formula

C₁₉H₂₆O₃

1 reference

Estriol methyl ether (English)

9 October 2016

canonical SMILES

CC12CCC3C(C1CC(C2O)O)CCC4=C3C=CC(=C4)OC

1 reference

Estriol methyl ether (English)

9 October 2016

isomeric SMILES

CC12CCC3C(C1C[C@H](C2O)O)CCC4=C3C=CC(=C4)OC

1 reference

Estriol methyl ether (English)

InChI=1S/C19H26O3/c1-19-8-7-14-13-6-4-12(22-2)9-11(13)3-5-15(14)16(19)10-17(20)18(19)21/h4,6,9,14-18,20-21H,3,5,7-8,10H2,1-2H3/t14?,15?,16?,17-,18?,19?/m1/s1

9 October 2016

Identifiers

InChI

1 reference

Estriol methyl ether (English)

UHQGCIIQUZBJAE-JZJKZLICSA-N

9 October 2016

InChIKey

2 references

Estriol methyl ether (English)

9 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(16alpha)-3-Methoxyestra-1,3,5(10)-triene-16,17-diol (English)

9 October 2016

2 references

Estriol methyl ether (English)

matched by identifier from

9 October 2016

InChIKey

UHQGCIIQUZBJAE-JZJKZLICSA-N

ChEBI ID

91918

mapping relation type

2 references

(16R)-3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-16,17-diol (English)