Spectrum_000229
Molecular Formula:
C47H79NO21
InChI: InChI=1/C47H79NO21/c1-19-7-12-47(48-14-19)20(2)45(3)11-9-24-23(40(45)69-47)6-5-21-13-22(8-10-46(21,24)4)62-41-35(59)33(57)37(28(17-51)65-41)66-43-36(60)38(31(55)27(16-50)64-43)67-44-39(29(53)25(52)18-61-44)68-42-34(58)32(56)30(54)26(15-49)63-42/h19-44,48-60H,5-18H2,1-4H3/t19-,20-,21u,22-,23u,24u,25+,26+,27+,28+,29-,30+,31+,32-,33+,34+,35+,36+,37-,38-,39+,40?,41-,42+,43+,44+,45+,46-,47-/m0/s1
InChIKey: InChIKey=FSQXVCNWJMITHZ-HTYDEYAXBI
SMILES: CC1CCC2(C(C3(CCC4C(C3O2)CCC5C4(CCC(C5)OC6C(C(C(C(O6)CO)OC7C(C(C(C(O7)CO)O)OC8C(C(C(CO8)O)O)OC9C(C(C(C(O9)CO)O)O)O)O)O)O)C)C)C)NC1
Names:
Spectrum_000229
Registries:
PubChem CID 6708777
PubChem ID 11494043
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