(Q105170491)

English

MRDFHICWVSPYMK-UHFFFAOYSA-N

group of stereoisomers with the chemical formula C₆₂H₁₀₀O₃₀

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Statements

group of stereoisomers

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oleanane triterpenoid

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oleanane triterpenoid

1,324.6299417999996 dalton

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based on heuristic

inferred from InChI

chemical formula

C₆₂H₁₀₀O₃₀

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canonical SMILES

O=C(OC1OCC(O)C(O)C1OC2OC(C)C(OC3OCC(O)C(OC4OCC(O)C(O)C4O)C3O)C(O)C2O)C56CCC(C)(C)CC6C7=CCC8C9(C)CC(O)C(OC%10OC(COC%11OCC(O)C(O)C%11O)C(O)C(O)C%10O)C(C)(C)C9CCC8(C)C7(C)CC5O

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Identifiers

InChI=1S/C62H100O30/c1-23-46(88-52-45(79)47(30(67)21-83-52)89-51-42(76)36(70)28(65)19-82-51)40(74)44(78)53(86-23)90-48-37(71)29(66)20-84-55(48)92-56(80)62-14-13-57(2,3)15-25(62)24-9-10-33-59(6)16-26(63)49(58(4,5)32(59)11-12-60(33,7)61(24,8)17-34(62)68)91-54-43(77)39(73)38(72)31(87-54)22-85-50-41(75)35(69)27(64)18-81-50/h9,23,25-55,63-79H,10-22H2,1-8H3

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MRDFHICWVSPYMK-UHFFFAOYSA-N

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2 references

15 September 2022

matched by identifier from

MRDFHICWVSPYMK-UHFFFAOYSA-N

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