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1-[(2S,3S,6R)-6-[2-(4-cyclopentyl-1-triazolyl)ethyl]-2-(hydroxymethyl)-3-oxanyl]-3-propylurea

PropertiesImage
MNX_IDMNXM339781 Image of MNXM339781
referencechebi:120278
formulaC19H33N5O3
global charge0
mol weight379.505
InChIKeyYRYFLIZLJGNRPZ-SOLBZPMBSA-N
InChIInChI=1S/C19H33N5O3/c1-2-10-20-19(26)21-16-8-7-15(27-18(16)13-25)9-11-24-12-17(22-23-24)14-5-3-4-6-14/h12,14-16,18,25H,2-11,13H2,1H3,(H2,20,21,26)/t15-,16+,18-/m1/s1
SMILESCCCNC(=O)N[C@H]1CC[C@H](CCN2C=C(C3CCCC3)N=N2)O[C@@H]1CO
MNX internals
InChI (mnx)InChI=1/C19H33N5O3/c1-2-10-20-19(26)21-16-8-7-15(27-18(16)13-25)9-11-24-12-17(22-23-24)14-5-3-4-6-14/h12,14-16,18,25H,2-11,13H2,1H3,(H2,20,21,26)/t15-,16+,18-/m1/s1 Image of MNXM339781
SMILES (mnx)[CH3:1][CH2:2][CH2:10][N:20]=[C:19]([NH:21][C@H:16]1[CH2:8][CH2:7][C@H:15]([CH2:9][CH2:11][N:24]2[CH:12]=[C:17]([CH:14]3[CH2:5][CH2:3][CH2:4][CH2:6]3)[N:22]=[N:23]2)[O:27][C@@H:18]1[CH2:13][OH:25])[OH:26]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:120278
chebi:120278
YRYFLIZLJGNRPZ-SOLBZPMBSA-N
1-[(2S,3S,6R)-6-[2-(4-cyclopentyl-1-triazolyl)ethyl]-2-(hydroxymethyl)-3-oxanyl]-3-propylurea