(Q104403643)

English

BYBNLTUPSXGVAV-UHFFFAOYSA-N

group of stereoisomers with the chemical formula C₅₇H₉₀O₂₆

In more languages

Statements

group of stereoisomers

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oleanane triterpenoid

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oleanane triterpenoid

1,190.572033 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₅₇H₉₀O₂₆

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canonical SMILES

O=C(O)C1OC(OC2CCC3(C)C(CCC4(C)C3CC=C5C6CC(C)(C)CCC6(C(=O)OC7OCC(O)C(O)C7OC8OC(C)C(OC9OCC(O)C(OC%10OCC(O)C(O)C%10O)C9O)C(O)C8O)C(O)CC54C)C2(C)C)C(O)C(O)C1O

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Aster yunnanensis

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Echinocystic Acid Saponins from Aster yunnanensis

Codonopsis lanceolata

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Phenolic glycosides and pyrrolidine alkaloids from Codonopsis tangshen

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Phenolic and triterpenoid glycosides from Aster batangensis

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An echinocystic acid saponin derivative from Kalimeris shimadae

Identifiers

InChI=1S/C57H90O26/c1-22-41(79-47-40(70)42(27(60)21-75-47)80-46-37(67)32(62)25(58)19-74-46)36(66)39(69)48(77-22)82-44-33(63)26(59)20-76-50(44)83-51(73)57-16-15-52(2,3)17-24(57)23-9-10-29-54(6)13-12-31(78-49-38(68)34(64)35(65)43(81-49)45(71)72)53(4,5)28(54)11-14-55(29,7)56(23,8)18-30(57)61/h9,22,24-44,46-50,58-70H,10-21H2,1-8H3,(H,71,72)

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BYBNLTUPSXGVAV-UHFFFAOYSA-N

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3 references

26 December 2021

15 September 2022

matched by identifier from

BYBNLTUPSXGVAV-UHFFFAOYSA-N

Human Metabolome Database ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

BYBNLTUPSXGVAV-UHFFFAOYSA-N

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