(Q105291415)

English

(1R,6S,9S,10R,13R)-3-benzoyl-6-(2-hydroxypropan-2-yl)-9-methyl-1,13-bis(3-methylbut-2-enyl)-5-oxatricyclo[7.2.2.04,10]tridec-3-ene-2,11-dione

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

chemical compound

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mass

518.303224444 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₃H₄₂O₅

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canonical SMILES

O=C(C=1C=CC=CC1)C=2C(=O)C3(C(=O)C4C2OC(CCC4(C)C(CC=C(C)C)C3)C(O)(C)C)CC=C(C)C

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isomeric SMILES

CC(C)=CC[C@@H]1C[C@@]2(CC=C(C)C)C(=O)C(C(=O)c3ccccc3)=C3O[C@H](C(C)(C)O)CC[C@]1(C)[C@H]3C2=O

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found in taxon

Garcinia cochinchinensis

2 references

stated in

Xanthones from the twigs of Cratoxylum cochinchinense

stated in

Guttiferones Q-S, cytotoxic polyisoprenylated benzophenones from the pericarp of Garcinia cochinchinensis

Cratoxylum cochinchinense

2 references

stated in

Xanthones from the twigs of Cratoxylum cochinchinense

stated in

Guttiferones Q-S, cytotoxic polyisoprenylated benzophenones from the pericarp of Garcinia cochinchinensis

Identifiers

InChI

InChI=1S/C33H42O5/c1-20(2)13-14-23-19-33(18-15-21(3)4)29(35)25(27(34)22-11-9-8-10-12-22)28-26(30(33)36)32(23,7)17-16-24(38-28)31(5,6)37/h8-13,15,23-24,26,37H,14,16-19H2,1-7H3/t23-,24+,26-,32+,33+/m1/s1

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InChIKey

VQQBQPQXIOXZPC-KWIYKSKYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

VQQBQPQXIOXZPC-KWIYKSKYSA-N

(Q105291415)

(1R,6S,9S,10R,13R)-3-benzoyl-6-(2-hydroxypropan-2-yl)-9-methyl-1,13-bis(3-methylbut-2-enyl)-5-oxatricyclo[7.2.2.04,10]tridec-3-ene-2,11-dione

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Identifiers

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