(Q105180271)

English

[1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]indol-3-yl]methyl acetate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

indole alkaloid

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mass

351.131802012 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₇H₂₁NO₇

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canonical SMILES

O=C(OCC1=CN(C=2C=CC=CC21)C3OC(CO)C(O)C(O)C3O)C

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isomeric SMILES

CC(=O)OCc1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2ccccc12

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found in taxon

Chimonanthus praecox

1 reference

stated in

Constituents from Chimonanthus praecox (wintersweet)

Identifiers

InChI

InChI=1S/C17H21NO7/c1-9(20)24-8-10-6-18(12-5-3-2-4-11(10)12)17-16(23)15(22)14(21)13(7-19)25-17/h2-6,13-17,19,21-23H,7-8H2,1H3/t13-,14-,15+,16-,17-/m1/s1

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InChIKey

NJQVDSROTARDQG-NQNKBUKLSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

NJQVDSROTARDQG-NQNKBUKLSA-N

(Q105180271)

[1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]indol-3-yl]methyl acetate

Statements

Identifiers

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