(Q83052770)

English

Thalfine

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

8,17,18,30-tetramethoxy-24-methyl-10,12,15,32-tetraoxa-4,24-diazaoctacyclo[31.2.2.1³,⁷.1²⁷,³¹.0⁹,¹³.0¹⁶,²¹.0²⁰,²⁵.0¹⁴,³⁹]nonatriaconta-1(35),3,5,7,9(13),14(39),16(21),17,19,27,29,31(38),33,36-tetradecaene

1 reference

based on heuristic

inferred from SMILES

mass

648.247166112 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₈H₃₆N₂O₈

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canonical SMILES

N=1C=CC=2C(OC)=C3OCOC3=C4OC=5C(OC)=C(OC)C=C6C5CCN(C)C6CC7=CC=C(OC)C(OC8=CC=C(C=C8)CC1C42)=C7

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isomeric SMILES

CN1CCC2=C3C(=C(C=C2[C@@H]1CC4=CC(=C(C=C4)OC)OC5=CC=C(CC6=NC=CC7=C6C(=C8C(=C7OC)OCO8)O3)C=C5)OC)OC

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found in taxon

Thalictrum foetidum

1 reference

stated in

Alkaloids of Thalictrum foetidum

Identifiers

InChI

InChI=1S/C38H36N2O8/c1-40-15-13-24-26-19-31(42-3)35(44-5)34(24)48-36-32-25(33(43-4)37-38(36)46-20-45-37)12-14-39-27(32)16-21-6-9-23(10-7-21)47-30-18-22(17-28(26)40)8-11-29(30)41-2/h6-12,14,18-19,28H,13,15-17,20H2,1-5H3/t28-/m0/s1

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InChIKey

OSOKLEWJPLGVBW-NDEPHWFRSA-N

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1 reference

matched by identifier from

InChIKey

OSOKLEWJPLGVBW-NDEPHWFRSA-N

1 reference

1 reference

matched by identifier from

InChIKey

OSOKLEWJPLGVBW-NDEPHWFRSA-N

DSSTOX compound identifier

DTXCID80104595

0 references

(Q83052770)

Thalfine

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Identifiers

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