(Q115972312)

English

9-[[(1S,2S,5S,6S,9S)-9,11,11-trimethyl-3-oxo-2-tricyclo[4.3.2.01,5]undecanyl]methyl]-1,7-dihydropurine-6,8-dione

chemical compound

In more languages

Statements

type of chemical entity

0 references

1 reference

based on heuristic

inferred from SMILES

370.200490692 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

6-(9'-Purine-6',8'-diolyl)-2beta-suberosanone

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₂₆N₄O₃

0 references

canonical SMILES

O=C1CC2C3CCC(C)C2(CC3(C)C)C1CN4C(O)=NC=5C(O)=NC=NC54

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isomeric SMILES

C[C@H]1CC[C@H]2[C@@H]3CC(=O)[C@H](Cn4c(O)nc5c(O)ncnc54)[C@@]13CC2(C)C

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Subergorgia suberosa

1 reference

Purine alkaloids from the South China Sea gorgonian Subergorgia suberosa

Identifiers

InChI=1S/C20H26N4O3/c1-10-4-5-11-12-6-14(25)13(20(10,12)8-19(11,2)3)7-24-16-15(23-18(24)27)17(26)22-9-21-16/h9-13H,4-8H2,1-3H3,(H,23,27)(H,21,22,26)/t10-,11-,12-,13-,20-/m0/s1

0 references

BHCRQXWMNOFEEK-BWZXQIPNSA-N

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1 reference

3 January 2023

based on heuristic

inferred from InChIKey

UniChem compound ID

1 reference

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