(Q105349678)

English

(1R,3aS,5aS,7S,9aS,11aR)-7-{[(2R,5S)-6-({[(3R,6S)-4,6-dihydroxy-2-methyloxan-3-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-3a,5a-dihydroxy-11a-methyl-1-(5-oxo-2H-furan-3-yl)-dodecahydro-1H-cyclopenta[a]phenanthrene-9a-carbaldehyde

group of stereoisomers with the chemical formula C₃₅H₅₂O₁₄

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Statements

instance of

group of stereoisomers

0 references

1 reference

696.335706344 dalton

1 reference

based on heuristic

inferred from isomeric SMILES

chemical formula

C₃₅H₅₂O₁₄

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canonical SMILES

O=CC12CCC(OC3OC(COC4C(O)CC(O)OC4C)C(O)C(O)C3O)CC2(O)CCC5C1CCC6(C)C(C7=CC(=O)OC7)CCC56O

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isomeric SMILES

CC1O[C@H](O)CC(O)[C@H]1OCC1O[C@@H](O[C@H]2CC[C@]3(C=O)C4CC[C@]5(C)[C@@H](C6=CC(=O)OC6)CC[C@]5(O)C4CC[C@]3(O)C2)C(O)C(O)[C@@H]1O

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found in taxon

Adonis mongolica

1 reference

stated in

Coumarins of Adonis mongolica

Erysimum marshallii

2 references

stated in

Cardenolide glycosides ofCheiranthus allioni. XV. Glucocheiranthoside

stated in

Cheiranthus allioni — A unique cardenolide-bearing plant

Corchorus olitorius

5 references

stated in

An investigation of the glycosides of jute. V. Coroloside and desglucocoroloside

stated in

Cardenolide glycosides from seeds of Corchorus olitorius

stated in

Cardiac glycosides from Corchorus olitorius

stated in

Identification and Analyses of Main Cardiac Glycosides in Corchorus olitorius Seeds and Their Acute Oral Toxicity to Mice

stated in

Relationship Between Cardiac Glycoside Contents and Color of Corchorus olitorius Seeds.

Erysimum cheiranthoides

1 reference

stated in

Cardenolides from Erysimum cheiranthoides

Erysimum contractum

1 reference

stated in

Cardiac glycosides of Erysimum contractum

Erysimum crepidifolium

1 reference

stated in

Cardiac glycosides of Erysimum crepidifolium

Erysimum diffusum

2 references

stated in

Erysimum glycosides IX. Sinapoyl ester of erysimoside in Erysimum diffusum

stated in

The isolation of erysimoside

Erysimum leptophyllum

1 reference

stated in

Cardiac glycosides ofErysimum leptophyllum

Erysimum pulchellum

1 reference

stated in

Cardiac glycosides of Erysimum pulchellum

Erysimum

1 reference

stated in

Analysis of erysimoside

Erysimum cheiri

1 reference

stated in

Cardenolides of Erysimum suffruticosum

Draba nemorosa

1 reference

stated in

Kaempferol glycosides and cardenolide glycosides, cytotoxic constituents from the seeds of Draba nemorosa (Brassicaceae).

Erysimum cuspidatum

1 reference

stated in

Erysimum glycosides X. Cardenolides of Erysimum cuspidatum

Identifiers

InChI

InChI=1S/C35H52O14/c1-17-30(23(37)12-26(39)47-17)46-15-24-27(40)28(41)29(42)31(49-24)48-19-3-8-33(16-36)21-4-7-32(2)20(18-11-25(38)45-14-18)6-10-35(32,44)22(21)5-9-34(33,43)13-19/h11,16-17,19-24,26-31,37,39-44H,3-10,12-15H2,1-2H3/t17?,19-,20+,21?,22?,23?,24?,26-,27+,28?,29?,30-,31+,32+,33-,34-,35-/m0/s1

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InChIKey

YKGXWWGUIXUCTH-OKDYQEHCSA-N

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1 reference

17 September 2022

inferred from InChIKey

1 reference

(Q105349678)

(1R,3aS,5aS,7S,9aS,11aR)-7-{[(2R,5S)-6-({[(3R,6S)-4,6-dihydroxy-2-methyloxan-3-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-3a,5a-dihydroxy-11a-methyl-1-(5-oxo-2H-furan-3-yl)-dodecahydro-1H-cyclopenta[a]phenanthrene-9a-carbaldehyde

Statements

Identifiers

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