(Q104403242)

English

3,6,10,24-Tetrahydroxy-20-(5-hydroxy-2,2-dimethylchromen-8-yl)-30-methyl-14-(3-methylbut-2-enyl)-7,15,19,21-tetraoxaoctacyclo[18.11.1.02,18.04,16.06,14.08,13.022,27.028,32]dotriaconta-2,4(16),8(13),9,11,17,22(27),23,25,30-decaen-5-one

group of stereoisomers with the chemical formula C₄₅H₄₀O₁₁

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Statements

instance of

group of stereoisomers

0 references

1 reference

756.2570621 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₄₅H₄₀O₁₁

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canonical SMILES

O=C1C=2C(O)=C3C(OC4(OC5=CC(O)=CC=C5C6CC(=CC3C64)C)C7=CC=C(O)C=8C=CC(OC87)(C)C)=CC2OC9(C%10=CC=C(O)C=C%10OC19O)CC=C(C)C

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found in taxon

Sorocea guilleminiana

1 reference

stated in

Prenylated flavanones from Sorocea ilicifolia

Sorocea hilarii

1 reference

stated in

Prenylated flavanones from Sorocea ilicifolia

Sorocea bonplandii

2 references

stated in

Three New Flavanone Derivatives from the Root Bark of Sorocea bonplandii Baillon

stated in

Prenylated flavanones from Sorocea ilicifolia

Identifiers

InChI

InChI=1S/C45H40O11/c1-21(2)12-15-43-29-9-7-24(47)19-33(29)55-45(43,51)41(50)37-35(52-43)20-34-36(39(37)49)28-17-22(3)16-27-25-8-6-23(46)18-32(25)53-44(54-34,38(27)28)30-10-11-31(48)26-13-14-42(4,5)56-40(26)30/h6-14,17-20,27-28,38,46-49,51H,15-16H2,1-5H3

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InChIKey

MGISFAXYYUFOCQ-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

MGISFAXYYUFOCQ-UHFFFAOYSA-N

(Q104403242)

3,6,10,24-Tetrahydroxy-20-(5-hydroxy-2,2-dimethylchromen-8-yl)-30-methyl-14-(3-methylbut-2-enyl)-7,15,19,21-tetraoxaoctacyclo[18.11.1.02,18.04,16.06,14.08,13.022,27.028,32]dotriaconta-2,4(16),8(13),9,11,17,22(27),23,25,30-decaen-5-one

Statements

Identifiers

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