(Q105027024)

English

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

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

[4,5-Dihydroxy-6-(4,5,9-trihydroxy-2-methyl-10-oxoanthracen-9-yl)oxan-3-yl] benzoate

1 reference

based on heuristic

inferred from SMILES

mass

492.142032348 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

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

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₇H₂₄O₉

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canonical SMILES

O=C(OC1COC(C(O)C1O)C2(O)C=3C=CC=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]1OC[C@@H](OC(=O)c3ccccc3)[C@@H](O)[C@@H]1O)c1cccc(O)c1C2=O

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found in taxon

Picramnia latifolia

1 reference

stated in

Anthrone and oxanthrone C-glycosides from Picramnia latifolia collected in Peru.

Identifiers

InChI

InChI=1S/C27H24O9/c1-13-10-16-21(18(29)11-13)23(31)20-15(8-5-9-17(20)28)27(16,34)25-24(32)22(30)19(12-35-25)36-26(33)14-6-3-2-4-7-14/h2-11,19,22,24-25,28-30,32,34H,12H2,1H3/t19-,22-,24+,25+,27-/m1/s1

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InChIKey

HESXYYVNWWHMEB-ZZQHRCADSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

HESXYYVNWWHMEB-ZZQHRCADSA-N

1 reference

(Q105027024)

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

Statements

Identifiers

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