(Q105021507)

English

3-[(1R,2S,3S)-2-(1H-indol-3-ylmethyl)-2,3-dimethyl-6-propan-2-ylidenecyclohexyl]propanoic acid

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

3-[2-(1H-indol-3-ylmethyl)-2,3-dimethyl-6-propan-2-ylidenecyclohexyl]propanoic acid

1 reference

based on heuristic

inferred from SMILES

mass

353.235479232 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₃H₃₁NO₂

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canonical SMILES

O=C(O)CCC1C(=C(C)C)CCC(C)C1(C)CC2=CNC=3C=CC=CC32

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isomeric SMILES

CC(C)=C1CC[C@H](C)[C@](C)(Cc2c[nH]c3ccccc23)[C@H]1CCC(=O)O

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found in taxon

Greenwayodendron suaveolens

1 reference

stated in

Suaveolindole, a new mass-limited antibacterial indolosesquiterpene from Greenwayodendron suaveolens obtained via high-throughput natural products chemistry methods

Polyalthia suaveolens

1 reference

stated in

Suaveolindole, a new mass-limited antibacterial indolosesquiterpene from Greenwayodendron suaveolens obtained via high-throughput natural products chemistry methods

Identifiers

InChI

InChI=1S/C23H31NO2/c1-15(2)18-10-9-16(3)23(4,20(18)11-12-22(25)26)13-17-14-24-21-8-6-5-7-19(17)21/h5-8,14,16,20,24H,9-13H2,1-4H3,(H,25,26)/t16-,20-,23-/m0/s1

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InChIKey

GVPCTDRGYRLXLX-GRWTVWFQSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

GVPCTDRGYRLXLX-GRWTVWFQSA-N

(Q105021507)

3-[(1R,2S,3S)-2-(1H-indol-3-ylmethyl)-2,3-dimethyl-6-propan-2-ylidenecyclohexyl]propanoic acid

Statements

Identifiers

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