(Q104986603)

English

[(2R,3S,4S,5S,6S)-3,4,5-trihydroxy-6-[(9S)-2,4,5,9-tetrahydroxy-7-methyl-10-oxoanthracen-9-yl]oxan-2-yl] benzoate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

[3,4,5-Trihydroxy-6-(2,4,5,9-tetrahydroxy-7-methyl-10-oxoanthracen-9-yl)oxan-2-yl] benzoate

1 reference

based on heuristic

inferred from SMILES

mass

524.131861588 dalton

1 reference

1 reference

1 reference

C₂₇H₂₄O₁₁

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canonical SMILES

O=C(OC1OC(C(O)C(O)C1O)C2(O)C=3C=C(O)C=C(O)C3C(=O)C4=C(O)C=C(C=C42)C)C=5C=CC=CC5

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isomeric SMILES

Cc1cc(O)c2c(c1)[C@@](O)([C@H]1O[C@H](OC(=O)c3ccccc3)[C@@H](O)[C@@H](O)[C@@H]1O)c1cc(O)cc(O)c1C2=O

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found in taxon

Picramnia antidesma

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stated in

Diastereomeric C-glycosyloxanthrones from picramnia antidesma

stated in

Cytotoxic anthraquinone derivatives from Picramnia antidesma

Picramnia teapensis

1 reference

stated in

Anthrone and oxanthrone C,O-diglycosides from Picramnia teapensis

Identifiers

InChI

InChI=1S/C27H24O11/c1-11-7-14-18(16(29)8-11)20(31)19-15(9-13(28)10-17(19)30)27(14,36)24-22(33)21(32)23(34)26(37-24)38-25(35)12-5-3-2-4-6-12/h2-10,21-24,26,28-30,32-34,36H,1H3/t21-,22-,23-,24-,26+,27-/m0/s1

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InChIKey

DPNMTGCWLLQQIW-DNYDSNSYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

DPNMTGCWLLQQIW-DNYDSNSYSA-N

(Q104986603)

[(2R,3S,4S,5S,6S)-3,4,5-trihydroxy-6-[(9S)-2,4,5,9-tetrahydroxy-7-methyl-10-oxoanthracen-9-yl]oxan-2-yl] benzoate

Statements

Identifiers

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