(Q105152657)

English

2,3a,5a-trihydroxy-11a-methyl-1-(6-oxopyran-3-yl)-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-dodecahydro-1H-cyclopenta[a]phenanthrene-9a-carbaldehyde

group of stereoisomers with the chemical formula C₃₀H₄₂O₁₂

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instance of

group of stereoisomers

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1 reference

594.2676267839998 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₀H₄₂O₁₂

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canonical SMILES

O=CC12CCC(OC3OC(CO)C(O)C(O)C3O)CC2(O)CCC4C1CCC5(C)C(C6=COC(=O)C=C6)C(O)CC45O

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Identifiers

InChI

InChI=1S/C30H42O12/c1-27-7-5-17-18(30(27,39)11-19(33)22(27)15-2-3-21(34)40-13-15)6-9-29(38)10-16(4-8-28(17,29)14-32)41-26-25(37)24(36)23(35)20(12-31)42-26/h2-3,13-14,16-20,22-26,31,33,35-39H,4-12H2,1H3

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InChIKey

LJMMDGJVOPWTGH-UHFFFAOYSA-N

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PubChem CID

14888413

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

LJMMDGJVOPWTGH-UHFFFAOYSA-N

(Q105152657)

2,3a,5a-trihydroxy-11a-methyl-1-(6-oxopyran-3-yl)-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-dodecahydro-1H-cyclopenta[a]phenanthrene-9a-carbaldehyde

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