(Q105024661)

English

4-{3a-hydroxy-7-[(3-hydroxy-4-methoxy-6-methyl-5-{[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}oxan-2-yl)oxy]-9a,11a-dimethyl-tetradecahydrocyclopenta[a]phenanthren-1-yl}-5H-furan-2-one

group of stereoisomers with the chemical formula C₄₂H₆₆O₁₈

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Statements

instance of

group of stereoisomers

0 references

1 reference

858.4249152720006 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₄₂H₆₆O₁₈

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canonical SMILES

O=C1OCC(=C1)C2CCC3(O)C4CCC5CC(OC6OC(C)C(OC7OC(COC8OC(CO)C(O)C(O)C8O)C(O)C(O)C7O)C(OC)C6O)CCC5(C)C4CCC23C

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found in taxon

Cerbera manghas

1 reference

stated in

Studies on cerbera. IV. Polar cardenolide glycosides from the leaves of Cerbera odollam and Cerbera manghas.

Thevetia neriifolia

3 references

stated in

Dinormonoterpenoids and their apiosylglucosides from Thevetia peruviana

stated in

Minor iridoids from Thevetia peruviana

stated in

THE CONSTITUENTS OF BE-STILL NUTS, THEVETIA NERIIFOLIA

Cascabela thevetia

3 references

stated in

Minor iridoids from Thevetia peruviana

stated in

THE CONSTITUENTS OF BE-STILL NUTS, THEVETIA NERIIFOLIA

stated in

Dinormonoterpenoids and their apiosylglucosides from Thevetia peruviana

Thevetia peruviana

3 references

stated in

Minor iridoids from Thevetia peruviana

stated in

THE CONSTITUENTS OF BE-STILL NUTS, THEVETIA NERIIFOLIA

stated in

Dinormonoterpenoids and their apiosylglucosides from Thevetia peruviana

Identifiers

InChI

InChI=1S/C42H66O18/c1-18-35(60-38-33(50)31(48)29(46)26(59-38)17-55-37-32(49)30(47)28(45)25(15-43)58-37)36(53-4)34(51)39(56-18)57-21-7-10-40(2)20(14-21)5-6-24-23(40)8-11-41(3)22(9-12-42(24,41)52)19-13-27(44)54-16-19/h13,18,20-26,28-39,43,45-52H,5-12,14-17H2,1-4H3

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InChIKey

GZVMBXDQUQRICT-UHFFFAOYSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

GZVMBXDQUQRICT-UHFFFAOYSA-N

1 reference

(Q105024661)

4-{3a-hydroxy-7-[(3-hydroxy-4-methoxy-6-methyl-5-{[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}oxan-2-yl)oxy]-9a,11a-dimethyl-tetradecahydrocyclopenta[a]phenanthren-1-yl}-5H-furan-2-one

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Identifiers

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