(Q104197530)

English

methyl 4,8,9-trihydroxy-7-[5-hydroxy-2-(1-hydroxy-4-methoxy-2-methyl-4-oxobutyl)-2-(methoxycarbonyl)-4-oxo-3H-1-benzopyran-6-yl]-3-methyl-1-oxo-3,4-dihydro-2H-xanthene-4a-carboxylate

group of stereoisomers with the chemical formula C₃₃H₃₄O₁₅

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instance of

group of stereoisomers

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1 reference

670.189770388 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₃H₃₄O₁₅

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canonical SMILES

O=C(OC)CC(C)C(O)C1(OC=2C=CC(=C(O)C2C(=O)C1)C3=CC=C4OC5(C(=O)OC)C(C(=O)CC(C)C5O)=C(O)C4=C3O)C(=O)OC

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Identifiers

InChI

InChI=1S/C33H34O15/c1-13-10-17(34)24-27(39)23-20(48-33(24,29(13)41)31(43)46-5)9-7-16(26(23)38)15-6-8-19-22(25(15)37)18(35)12-32(47-19,30(42)45-4)28(40)14(2)11-21(36)44-3/h6-9,13-14,28-29,37-41H,10-12H2,1-5H3

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InChIKey

SQSNPCJTBKSTEC-UHFFFAOYSA-N

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PubChem CID

162816759

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

SQSNPCJTBKSTEC-UHFFFAOYSA-N

(Q104197530)

methyl 4,8,9-trihydroxy-7-[5-hydroxy-2-(1-hydroxy-4-methoxy-2-methyl-4-oxobutyl)-2-(methoxycarbonyl)-4-oxo-3H-1-benzopyran-6-yl]-3-methyl-1-oxo-3,4-dihydro-2H-xanthene-4a-carboxylate

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