(Q105230001)

English

(1R,12R,15S,17S)-1,14,14-trimethyl-3,13-diazapentacyclo[13.2.2.02,10.04,9.012,17]nonadeca-2(10),4,6,8-tetraene

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

alkaloid

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mass

294.209598832 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1S,12R,15S,17S)-1,14,14-trimethyl-3,13-diazapentacyclo[13.2.2.02,10.04,9.012,17]nonadeca-2(10),4,6,8-tetraene

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₂₆N₂

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canonical SMILES

C=1C=CC2=C(C1)NC3=C2CC4NC(C)(C)C5CCC3(C)C4C5

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isomeric SMILES

CC1(C)N[C@@H]2Cc3c([nH]c4ccccc34)[C@]3(C)CC[C@H]1C[C@H]23

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found in taxon

Aristotelia chilensis

2 references

stated in

Structure of aristone, a unique indole alkaloid from Aristotelia chilensis(mol.) stuntz, by X-ray crystallographic analysis

stated in

Aristoteline and aristotelone, unusual indole alkaloids from Aristotelia chilensis

Aristotelia peduncularis

1 reference

stated in

Tasmanin, ein neues Indolalkaloid ausAristotelia peduncularis(LABILL.) HOOK. F. 181. Mitteilung über organische Naturstoffe

Aristotelia serrata

2 references

stated in

Aristotelinone and serratoline: New indole alkaloids from Aristotelia serrata W.R.B. Oliver

stated in

Aristoteline, a novel indole alkaloid: X-ray structural determination

Identifiers

InChI

InChI=1S/C20H26N2/c1-19(2)12-8-9-20(3)15(10-12)17(22-19)11-14-13-6-4-5-7-16(13)21-18(14)20/h4-7,12,15,17,21-22H,8-11H2,1-3H3/t12-,15+,17+,20+/m0/s1

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InChIKey

QYBCOSRUKXCALD-GHHTXBMSSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

QYBCOSRUKXCALD-GHHTXBMSSA-N

1 reference

(Q105230001)

(1R,12R,15S,17S)-1,14,14-trimethyl-3,13-diazapentacyclo[13.2.2.02,10.04,9.012,17]nonadeca-2(10),4,6,8-tetraene

Statements

Identifiers

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