(Q105149540)

English

[14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-16-yl] acetate

group of stereoisomers with the chemical formula C₃₁H₄₆O₁₀

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Statements

instance of

group of stereoisomers

0 references

1 reference

578.309097672 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₁H₄₆O₁₀

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canonical SMILES

O=C1OCC(=C1)C2C(OC(=O)C)CC3(O)C4CCC5CC(OC6OC(C)C(O)C(O)C6O)CCC5(C)C4CCC23C

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found in taxon

Trewia nudiflora

1 reference

stated in

Cardenolides and Cardiac Aglycone from the Stem Bark ofTrewia nudiflora

Identifiers

InChI

InChI=1S/C31H46O10/c1-15-25(34)26(35)27(36)28(39-15)41-19-7-9-29(3)18(12-19)5-6-21-20(29)8-10-30(4)24(17-11-23(33)38-14-17)22(40-16(2)32)13-31(21,30)37/h11,15,18-22,24-28,34-37H,5-10,12-14H2,1-4H3

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InChIKey

LBPZKMZBSNQRII-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

LBPZKMZBSNQRII-UHFFFAOYSA-N

1 reference

(Q105149540)

[14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-16-yl] acetate

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Identifiers

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