(Q104167794)

English

13-Chloro-12-ethenyl-8,8,12,19,19-pentamethyl-6-azapentacyclo[13.3.1.05,18.07,17.011,16]nonadeca-1(18),2,4,7(17),9,11(16)-hexaene-9-carbonitrile

group of stereoisomers with the chemical formula C₂₆H₂₇ClN₂

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Statements

instance of

group of stereoisomers

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subclass of

naphtho[1,2,3-cd]indole alkaloid

1 reference

inferred from

naphtho[1,2,3-cd]indole alkaloid

mass

402.186276544 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₆H₂₇ClN₂

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canonical SMILES

N#CC1=CC2=C3C=4C=5C(=CC=CC5C(C)(C)C3CC(Cl)C2(C=C)C)NC4C1(C)C

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found in taxon

Fischerella ambigua

1 reference

stated in

Identifiers

InChI

InChI=1S/C26H27ClN2/c1-7-26(6)17-11-14(13-28)24(2,3)23-22-20(17)16(12-19(26)27)25(4,5)15-9-8-10-18(29-23)21(15)22/h7-11,16,19,29H,1,12H2,2-6H3

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InChIKey

HFHQOKOLRORURO-UHFFFAOYSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

HFHQOKOLRORURO-UHFFFAOYSA-N

(Q104167794)

13-Chloro-12-ethenyl-8,8,12,19,19-pentamethyl-6-azapentacyclo[13.3.1.05,18.07,17.011,16]nonadeca-1(18),2,4,7(17),9,11(16)-hexaene-9-carbonitrile

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Identifiers

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