(Q105189221)

English

(2S)-2-(1-Hydroxy-1-methylethyl)-4-butyryl-5-hydroxy-6-phenyl-1,2-dihydro-3,9-dioxa-8H-benzo[e]indene-8-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

4-phenylcoumarin flavonoid

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mass

408.157288488 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(8R)-6-butanoyl-5-hydroxy-8-(2-hydroxypropan-2-yl)-4-phenyl-8,9-dihydrofuro[2,3-h]chromen-2-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₄H₂₄O₆

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canonical SMILES

O=C1OC2=C(C(O)=C(C(=O)CCC)C=3OC(CC23)C(O)(C)C)C(=C1)C=4C=CC=CC4

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isomeric SMILES

CCCC(=O)c1c2c(c3oc(=O)cc(-c4ccccc4)c3c1O)C[C@@H](C(C)(C)O)O2

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found in taxon

Mesua racemosa

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stated in

6-Acylcoumarins from Mesua racemosa

Mammea punctata

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stated in

New cytotoxic coumarins and prenylated benzophenone derivatives from the bark of Ochrocarpos punctatus from the Madagascar rainforest

Calophyllum dispar

1 reference

stated in

Novel cytotoxic 4-phenylfuranocoumarins from Calophyllum dispar

Identifiers

InChI

InChI=1S/C24H24O6/c1-4-8-16(25)20-21(27)19-14(13-9-6-5-7-10-13)12-18(26)30-22(19)15-11-17(24(2,3)28)29-23(15)20/h5-7,9-10,12,17,27-28H,4,8,11H2,1-3H3/t17-/m0/s1

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InChIKey

OBYOQQBVJXSKIF-KRWDZBQOSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

OBYOQQBVJXSKIF-KRWDZBQOSA-N

1 reference

(Q105189221)

(2S)-2-(1-Hydroxy-1-methylethyl)-4-butyryl-5-hydroxy-6-phenyl-1,2-dihydro-3,9-dioxa-8H-benzo[e]indene-8-one

Statements

Identifiers

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