(Q105249435)

English

SBHDFWSMZQXJLS-UHFFFAOYSA-N

group of stereoisomers with the chemical formula C₅₉H₉₆O₂₇

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Statements

group of stereoisomers

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oleanane triterpenoid

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oleanane triterpenoid

1,236.613897812 dalton

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based on heuristic

inferred from InChI

chemical formula

C₅₉H₉₆O₂₇

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canonical SMILES

O=C(OC1OC(COC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O)C34CCC(C)(C)CC4C5=CCC6C7(C)CCC(OC8OC(CO)C(OC9OC(CO)C(O)C9OC%10OC(CO)C(O)C(O)C%10O)C(O)C8O)C(C)(C)C7CCC6(C)C5(C)CC3

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Identifiers

InChI=1S/C59H96O27/c1-54(2)14-16-59(53(76)86-51-44(74)40(70)36(66)30(82-51)23-77-48-42(72)38(68)34(64)26(19-60)78-48)17-15-57(6)24(25(59)18-54)8-9-32-56(5)12-11-33(55(3,4)31(56)10-13-58(32,57)7)83-49-45(75)41(71)46(29(22-63)81-49)84-52-47(37(67)28(21-62)80-52)85-50-43(73)39(69)35(65)27(20-61)79-50/h8,25-52,60-75H,9-23H2,1-7H3

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SBHDFWSMZQXJLS-UHFFFAOYSA-N

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2 references

15 September 2022

matched by identifier from

SBHDFWSMZQXJLS-UHFFFAOYSA-N

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