(Q105194520)

English

OMURHGVYPGDXOT-UHFFFAOYSA-N

group of stereoisomers with the chemical formula C₅₂H₈₄O₁₉

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Statements

group of stereoisomers

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oleanane triterpenoid

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oleanane triterpenoid

1,012.560680468 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₅₂H₈₄O₁₉

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canonical SMILES

O=C(OC1C(O)C2(CO)C(O)CC3(C(=CCC4C5(C)CCC(OC6OCC(OC7OC(C)C(O)C(O)C7O)C(O)C6OC8OC(CO)C(O)C(O)C8O)C(C)(C)C5CCC43C)C2CC1(C)C)C)C(=CC)C

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Maesa lanceolata

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Triterpene saponins of Maesa lanceolata leaves

Identifiers

InChI=1S/C52H84O19/c1-11-23(2)43(64)71-42-41(63)52(22-54)26(18-47(42,4)5)25-12-13-30-49(8)16-15-32(48(6,7)29(49)14-17-50(30,9)51(25,10)19-31(52)55)69-46-40(70-45-39(62)37(60)34(57)27(20-53)67-45)35(58)28(21-65-46)68-44-38(61)36(59)33(56)24(3)66-44/h11-12,24,26-42,44-46,53-63H,13-22H2,1-10H3

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OMURHGVYPGDXOT-UHFFFAOYSA-N

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1 reference

15 September 2022

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