(Q105170625)

English

6-(beta-D-Glucopyranosyl)benzo[f]-1,3-benzodioxolo[6,5,4-cd]indole-5(6H)-one

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

10-[3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl]-3,5-dioxa-10-azapentacyclo[9.7.1.02,6.08,19.013,18]nonadeca-1(19),2(6),7,11,13,15,17-heptaen-9-one

1 reference

based on heuristic

inferred from SMILES

mass

425.111066568 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₁₉NO₈

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canonical SMILES

O=C1C2=CC=3OCOC3C=4C=5C=CC=CC5C=C(C24)N1C6OC(CO)C(O)C(O)C6O

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isomeric SMILES

O=C1c2cc3c(c4c2c(cc2ccccc24)N1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OCO3

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found in taxon

Aristolochia heterophylla

1 reference

stated in

The constituents of the root and stem of Aristolochia heterophylla Hemsl

Aristolochia kaempferi

1 reference

stated in

The constituents of the root and stem of Aristolochia heterophylla Hemsl

Common rose

1 reference

stated in

Aristolochic Acids as a Defensive Substance for the Aristolochiaceous Plant-Feeding Swallowtail Butterfly,Pachliopta aristolochiae interpositus

Identifiers

InChI

InChI=1S/C22H19NO8/c24-7-14-17(25)18(26)19(27)22(31-14)23-12-5-9-3-1-2-4-10(9)16-15(12)11(21(23)28)6-13-20(16)30-8-29-13/h1-6,14,17-19,22,24-27H,7-8H2/t14-,17-,18+,19-,22-/m1/s1

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InChIKey

MRIPMVIIGBYUCC-MAEOEUOPSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

MRIPMVIIGBYUCC-MAEOEUOPSA-N

1 reference

(Q105170625)

6-(beta-D-Glucopyranosyl)benzo[f]-1,3-benzodioxolo[6,5,4-cd]indole-5(6H)-one

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