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UZD

Summary
Name:methyl 6-O-(heptylcarbamoyl)-beta-L-altropyranoside
Formula:C15 H29 N O7
Formal charge:0
Formula weight:335.393 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.01methyl 6-O-(heptylcarbamoyl)-beta-L-altropyranoside
OpenEye OEToolkits2.0.7[(2~{S},3~{R},4~{S},5~{R},6~{S})-6-methoxy-3,4,5-tris(oxidanyl)oxan-2-yl]methyl ~{N}-heptylcarbamate

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C(OCC1OC(C(C(C1O)O)O)OC)NCCCCCCC
InChIInChI1.03InChI=1S/C15H29NO7/c1-3-4-5-6-7-8-16-15(20)22-9-10-11(17)12(18)13(19)14(21-2)23-10/h10-14,17-19H,3-9H2,1-2H3,(H,16,20)/t10-,11-,12-,13+,14-/m0/s1
InChIKeyInChI1.03XPIVOYOQXKNYHA-YHQUGGNUSA-N
SMILES_CANONICALCACTVS3.385CCCCCCCNC(=O)OC[C@@H]1O[C@H](OC)[C@H](O)[C@@H](O)[C@H]1O
SMILESCACTVS3.385CCCCCCCNC(=O)OC[CH]1O[CH](OC)[CH](O)[CH](O)[CH]1O
SMILES_CANONICALOpenEye OEToolkits2.0.7CCCCCCCNC(=O)OC[C@H]1[C@@H]([C@@H]([C@H]([C@H](O1)OC)O)O)O
SMILESOpenEye OEToolkits2.0.7CCCCCCCNC(=O)OCC1C(C(C(C(O1)OC)O)O)O

223790

数据于2024-08-14公开中

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