(Q105023225)

English

3-(1,1-Dimethylallyl)-7beta-hydroxy-8,8-dimethyl-7,8-dihydro-2H,6H-benzo[1,2-b:5,4-b']dipyran-2-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

pyranocoumarins

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mass

314.151809184 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₉H₂₂O₄

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canonical SMILES

O=C1OC=2C=C3OC(C)(C)C(O)CC3=CC2C=C1C(C=C)(C)C

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isomeric SMILES

C=CC(C)(C)c1cc2cc3c(cc2oc1=O)OC(C)(C)[C@H](O)C3

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found in taxon

Helietta apiculata

1 reference

stated in

Quinoline alkaloids, coumarins and volatile constituents of Helietta longifoliata.

Identifiers

InChI

InChI=1S/C19H22O4/c1-6-18(2,3)13-8-11-7-12-9-16(20)19(4,5)23-15(12)10-14(11)22-17(13)21/h6-8,10,16,20H,1,9H2,2-5H3/t16-/m1/s1

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InChIKey

GXNOBSWJKBHASE-MRXNPFEDSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

GXNOBSWJKBHASE-MRXNPFEDSA-N

1 reference

(Q105023225)

3-(1,1-Dimethylallyl)-7beta-hydroxy-8,8-dimethyl-7,8-dihydro-2H,6H-benzo[1,2-b:5,4-b']dipyran-2-one

Statements

Identifiers

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