(Q104981078)

English

(1R,5R,7R)-3-(3,4-dihydroxybenzoyl)-4-hydroxy-5-[(2S)-4-hydroxy-5-methyl-2-(prop-1-en-2-yl)hex-5-en-1-yl]-8,8-dimethyl-1,7-bis(3-methylbut-2-en-1-yl)bicyclo[3.3.1]non-3-ene-2,9-dione

group of stereoisomers with the chemical formula C₃₈H₅₀O₇

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

618.35565394 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₃₈H₅₀O₇

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canonical SMILES

O=C(C1=CC=C(O)C(O)=C1)C=2C(=O)C3(C(=O)C(C2O)(CC(C(=C)C)CC(O)C(=C)C)CC(CC=C(C)C)C3(C)C)CC=C(C)C

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isomeric SMILES

C=C(C)C(O)C[C@H](C[C@@]12C[C@@H](CC=C(C)C)C(C)(C)[C@@](CC=C(C)C)(C(=O)C(C(=O)c3ccc(O)c(O)c3)=C1O)C2=O)C(=C)C

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found in taxon

Garcinia multiflora

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stated in

Apoptotic Effects of Polyprenylated Benzoylphloroglucinol Derivatives from the Twigs of Garcinia multiflora

Garcinia esculenta

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stated in

Cytotoxic and anti-inflammatory prenylated benzoylphloroglucinols and xanthones from the twigs of Garcinia esculenta

Identifiers

InChI

InChI=1S/C38H50O7/c1-21(2)11-13-27-20-37(19-26(23(5)6)18-29(40)24(7)8)33(43)31(32(42)25-12-14-28(39)30(41)17-25)34(44)38(35(37)45,36(27,9)10)16-15-22(3)4/h11-12,14-15,17,26-27,29,39-41,43H,5,7,13,16,18-20H2,1-4,6,8-10H3/t26-,27-,29?,37-,38+/m1/s1

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InChIKey

DIAUICLIYKIHDM-UWMGRSOSSA-N

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(Q104981078)

(1R,5R,7R)-3-(3,4-dihydroxybenzoyl)-4-hydroxy-5-[(2S)-4-hydroxy-5-methyl-2-(prop-1-en-2-yl)hex-5-en-1-yl]-8,8-dimethyl-1,7-bis(3-methylbut-2-en-1-yl)bicyclo[3.3.1]non-3-ene-2,9-dione

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