(Q105221741)

English

Tarasaponin III

group of stereoisomers with the chemical formula C₄₆H₇₄O₁₆

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Statements

group of stereoisomers

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oleanane triterpenoid

1 reference

oleanane triterpenoid

882.4976862880005 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₄₆H₇₄O₁₆

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canonical SMILES

O=C(O)C12CCC(C)(C)CC2C3=CCC4C5(C)CCC(OC6OCC(O)C(OC7OC(CO)C(O)C(O)C7O)C6OC8OCC(O)C(O)C8O)C(C)(C)C5CCC4(C)C3(C)CC1

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Identifiers

InChI=1S/C46H74O16/c1-41(2)14-16-46(40(55)56)17-15-44(6)22(23(46)18-41)8-9-28-43(5)12-11-29(42(3,4)27(43)10-13-45(28,44)7)60-39-36(62-37-33(53)30(50)24(48)20-57-37)35(25(49)21-58-39)61-38-34(54)32(52)31(51)26(19-47)59-38/h8,23-39,47-54H,9-21H2,1-7H3,(H,55,56)

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QISCHUABGXFSHX-UHFFFAOYSA-N

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2 references

based on heuristic

inferred from InChIKey

matched by identifier from

QISCHUABGXFSHX-UHFFFAOYSA-N

UniChem compound ID

1 reference

Human Metabolome Database ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

QISCHUABGXFSHX-UHFFFAOYSA-N

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