(Q104963815)

English

7-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-6-methoxychromen-2-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

7-[4,5-Dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-6-methoxychromen-2-one

1 reference

based on heuristic

inferred from SMILES

mass

500.152990956 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₂₈O₁₃

0 references

canonical SMILES

O=C1OC=2C=C(OC3OC(CO)C(O)C(O)C3OC4OC(C)C(O)C(O)C4O)C(OC)=CC2C=C1

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isomeric SMILES

COc1cc2ccc(=O)oc2cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O

0 references

found in taxon

Haplophyllum acutifolium

2 references

stated in

Coumarin glycosides ofHaplophyllum performatum. structures of haploperosides C, D, and E

stated in

Coumarin glycosides ofHaplophyllum perforatum

Identifiers

InChI

InChI=1S/C22H28O13/c1-8-15(25)17(27)19(29)21(31-8)35-20-18(28)16(26)13(7-23)34-22(20)33-12-6-10-9(5-11(12)30-2)3-4-14(24)32-10/h3-6,8,13,15-23,25-29H,7H2,1-2H3/t8-,13+,15-,16+,17+,18-,19+,20+,21-,22+/m0/s1

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InChIKey

CLQDVLOGUJFGQR-PFBWUSNGSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

CLQDVLOGUJFGQR-PFBWUSNGSA-N

1 reference

(Q104963815)

7-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-6-methoxychromen-2-one

Statements

Identifiers

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