(Q105141935)

English

[3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl] 5-hydroxy-7-(1-hydroxypropan-2-yl)-1,4a-dimethyl-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate

group of stereoisomers with the chemical formula C₃₂H₄₈O₁₅

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instance of

group of stereoisomers

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1 reference

672.299320836 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₃₂H₄₈O₁₅

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canonical SMILES

O=C(OC1OC(CO)C(O)C(O)C1O)C2(C)CCCC3(C=4C(O)=C(OC5OC(CO)C(O)C(O)C5O)C(=CC4CCC23)C(C)CO)C

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Identifiers

InChI

InChI=1S/C32H48O15/c1-13(10-33)15-9-14-5-6-18-31(2,19(14)22(38)27(15)46-28-25(41)23(39)20(36)16(11-34)44-28)7-4-8-32(18,3)30(43)47-29-26(42)24(40)21(37)17(12-35)45-29/h9,13,16-18,20-21,23-26,28-29,33-42H,4-8,10-12H2,1-3H3

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InChIKey

KJRLDWGHZUUHJO-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

KJRLDWGHZUUHJO-UHFFFAOYSA-N

(Q105141935)

[3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl] 5-hydroxy-7-(1-hydroxypropan-2-yl)-1,4a-dimethyl-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate

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