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Murcko scaffold

Ring system with 3 rings and 18 atoms

17 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
18
Chemicals
17
With full pages
7
Scaffold SMILES

O=C1Nc2ccccc2OC1OC1CCCCO1

A Bemis-Murcko scaffold is what remains of a molecule when every side chain is removed: the rings and the chains that link them. Chemicals that share a scaffold often belong to the same compound series, which helps when you look for analogues, alternative suppliers or related building blocks.

Substructure search with this scaffold
Murcko scaffold O=C1Nc2ccccc2OC1OC1CCCCO1

Computed from the structures of the chemicals listed here. Stereo and charges are removed before the scaffold is taken.

Chemicals with this scaffold

Open one to see its structure, properties and suppliers.

Showing 1 to 17 of 17 chemicals

2-(beta-D-Glucopyranosyloxy)-7-methoxy-2H-1,4-benzoxazin-3(4H)-one chemical structure, C15H19NO9, CAS 17622-26-3
2-(beta-D-Glucopyranosyloxy)-7-methoxy-2H-1,4-benzoxazin-3(4H)-one
CAS 17622-26-3C15H19NO9
(2R)-DIMBOA glucoside chemical structure, C15H19NO10, CAS 113565-32-5
(2R)-DIMBOA glucoside
CAS 113565-32-5C15H19NO10
DHBOA-Glc chemical structure, C14H17NO9
DHBOA-Glc
C14H17NO9
2-(2,4-Dihydroxy-1,4(2H)-benzoxazin-3(4H)-one)-beta-D-glucopyranoside chemical structure, C14H17NO9, CAS 22260-47-5
2-(2,4-Dihydroxy-1,4(2H)-benzoxazin-3(4H)-one)-beta-D-glucopyranoside
CAS 22260-47-5C14H17NO9
DIBOA beta-D-glucoside chemical structure, C14H17NO9, CAS 155835-54-4
DIBOA beta-D-glucoside
CAS 155835-54-4C14H17NO9
HDMBOA-Glc chemical structure, C16H21NO10, CAS 113565-33-6
HDMBOA-Glc
CAS 113565-33-6C16H21NO10
DIM2BOA-beta-D-glucoside chemical structure, C16H21NO11, CAS 40246-08-0
DIM2BOA-beta-D-glucoside
CAS 40246-08-0C16H21NO11
2-O-Glucosyl-2,4-dihydroxy-7-methoxy-1,4-benzoxazin-3-one chemical structure, C15H19NO10, CAS 18607-79-9
2-O-Glucosyl-2,4-dihydroxy-7-methoxy-1,4-benzoxazin-3-one
CAS 18607-79-9C15H19NO10
Blepharin chemical structure, C14H17NO8, CAS 27625-86-1
Blepharin
CAS 27625-86-1C14H17NO8
2-beta-d-Glucopyranosyloxy-1,4-benzoxazin-3-one chemical structure, C14H17NO8, CAS 285134-43-2
2-beta-d-Glucopyranosyloxy-1,4-benzoxazin-3-one
CAS 285134-43-2C14H17NO8
2H-1,4-Benzoxazin-3(4H)-one, 2-(beta-D-glucopyranosyloxy)-7-hydroxy- chemical structure, C14H17NO9
2H-1,4-Benzoxazin-3(4H)-one, 2-(beta-D-glucopyranosyloxy)-7-hydroxy-
C14H17NO9
4,7-Dimethoxy-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4-benzoxazin-3-one chemical structure, C16H21NO10
4,7-Dimethoxy-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4-benzoxazin-3-one
C16H21NO10
NCGC00385507-01_C14H17NO9_(2S)-7-Hydroxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl beta-D-glucopyranoside chemical structure, C14H17NO9, CAS 28512-70-1
NCGC00385507-01_C14H17NO9_(2S)-7-Hydroxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl beta-D-glucopyranoside
CAS 28512-70-1C14H17NO9
TRIBOA beta-D-glucoside chemical structure, C14H17NO10, CAS 1020171-61-2
TRIBOA beta-D-glucoside
CAS 1020171-61-2C14H17NO10
2-(I(2)-D-Glucopyranosyloxy)-7,8-dimethoxy-2H-1,4-benzoxazin-3(4H)-one chemical structure, C16H21NO10, CAS 40246-09-1
2-(I(2)-D-Glucopyranosyloxy)-7,8-dimethoxy-2H-1,4-benzoxazin-3(4H)-one
CAS 40246-09-1C16H21NO10
4D3Utv959P chemical structure, C14H17NO9
4D3Utv959P
C14H17NO9
2-beta-D-Glucuronopyranosyloxy-1,4-benzoxazin-3-one chemical structure, C14H15NO9, CAS 1613271-29-6
2-beta-D-Glucuronopyranosyloxy-1,4-benzoxazin-3-one
CAS 1613271-29-6C14H15NO9