(Q105137357)

English

(1R,10R,12R,15S,17S,19R)-1,14,14-trimethyl-3,13-diazapentacyclo[13.2.2.02,10.04,9.012,17]nonadeca-2,4,6,8-tetraene-10,19-diol

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

alkaloid

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mass

326.199428072 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₂₆N₂O₂

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canonical SMILES

OC1CC2(C3=NC=4C=CC=CC4C3(O)CC5NC(C)(C)C1CC52)C

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isomeric SMILES

CC1(C)N[C@@H]2C[C@]3(O)C(=Nc4ccccc43)[C@]3(C)C[C@@H](O)[C@H]1C[C@H]23

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found in taxon

Aristotelia chilensis

1 reference

stated in

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

Identifiers

InChI

InChI=1S/C20H26N2O2/c1-18(2)13-8-12-15(22-18)9-20(24)11-6-4-5-7-14(11)21-17(20)19(12,3)10-16(13)23/h4-7,12-13,15-16,22-24H,8-10H2,1-3H3/t12-,13-,15-,16-,19-,20-/m1/s1

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InChIKey

JZECANPAOKDOSF-JRBQSMGMSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

JZECANPAOKDOSF-JRBQSMGMSA-N

1 reference

(Q105137357)

(1R,10R,12R,15S,17S,19R)-1,14,14-trimethyl-3,13-diazapentacyclo[13.2.2.02,10.04,9.012,17]nonadeca-2,4,6,8-tetraene-10,19-diol

Statements

Identifiers

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