(Q105236094)

English

[4a-Hydroxy-7-methyl-7-(3-phenylprop-2-enoyloxy)-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,5,6,7a-tetrahydrocyclopenta[c]pyran-5-yl] 3-phenylprop-2-enoate

group of stereoisomers with the chemical formula C₃₃H₃₆O₁₂

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instance of

group of stereoisomers

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1 reference

624.633 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₃H₃₆O₁₂

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canonical SMILES

O=C(OC1CC(OC(=O)C=CC=2C=CC=CC2)(C)C3C(OC=CC13O)OC4OC(CO)C(O)C(O)C4O)C=CC=5C=CC=CC5

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Identifiers

InChI

InChI=1S/C33H36O12/c1-32(45-25(36)15-13-21-10-6-3-7-11-21)18-23(43-24(35)14-12-20-8-4-2-5-9-20)33(40)16-17-41-31(29(32)33)44-30-28(39)27(38)26(37)22(19-34)42-30/h2-17,22-23,26-31,34,37-40H,18-19H2,1H3

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InChIKey

RGTYZRPQZIEUER-UHFFFAOYSA-N

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PubChem CID

162906694

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

RGTYZRPQZIEUER-UHFFFAOYSA-N

(Q105236094)

[4a-Hydroxy-7-methyl-7-(3-phenylprop-2-enoyloxy)-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,5,6,7a-tetrahydrocyclopenta[c]pyran-5-yl] 3-phenylprop-2-enoate

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