Ro4-1539 (Q7339200)

CID20834001 (English)

(1S,9S,10S)-17-[2-(furan-2-yl)ethyl]-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-4-ol

21 September 2016

stereoisomer of

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₂H₂₇NO₂

1 reference

CID20834001 (English)

21 September 2016

canonical SMILES

C1CCC23CCN(C(C2C1)CC4=C3C=C(C=C4)O)CCC5=CC=CO5

1 reference

CID20834001 (English)

21 September 2016

isomeric SMILES

C1CC[C@@]23CCN([C@@H]([C@@H]2C1)CC4=C3C=C(C=C4)O)CCC5=CC=CO5

1 reference

CID20834001 (English)

InChI=1S/C22H27NO2/c24-17-7-6-16-14-21-19-5-1-2-9-22(19,20(16)15-17)10-12-23(21)11-8-18-4-3-13-25-18/h3-4,6-7,13,15,19,21,24H,1-2,5,8-12,14H2/t19-,21+,22+/m0/s1

21 September 2016

Identifiers

InChI

1 reference

CID20834001 (English)

ANCZOEKEGCHEKY-KSEOMHKRSA-N

21 September 2016

InChIKey

1 reference

CID20834001 (English)

imported from Wikimedia project

21 September 2016

CAS Registry Number

27767-85-7

1 reference

1 reference

17-[2-(2-Furyl)ethyl]morphinan-3-ol (English)

21 September 2016

1 reference

(13alpha,14alpha)-17-[2-(2-Furyl)ethyl]morphinan-3-ol (English)

21 September 2016

1 reference

(9alpha,14alpha)-17-[2-(2-Furyl)ethyl]morphinan-3-ol (English)

21 September 2016

2 references

CID20834001 (English)