(Q104956477)

English

3,4,5-Trihydroxy-6-[[16-hydroxy-10,13-dimethyl-17-(6-methyl-4-oxoheptan-2-yl)-15-oxo-1,2,3,4,5,6,7,8,9,11,12,14-dodecahydrocyclopenta[a]phenanthren-3-yl]oxy]oxane-2-carboxylic acid

group of stereoisomers with the chemical formula C₃₃H₅₀O₁₀

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instance of

group of stereoisomers

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1 reference

606.3403977999999 dalton

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based on heuristic

inferred from InChI

chemical formula

C₃₃H₅₀O₁₀

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canonical SMILES

O=C(O)C1OC(OC2CCC3(C)C(CCC4C5C(=O)C(O)=C(C(C)CC(=O)CC(C)C)C5(C)CCC43)C2)C(O)C(O)C1O

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Identifiers

InChI

InChI=1S/C33H50O10/c1-15(2)12-18(34)13-16(3)22-24(35)25(36)23-20-7-6-17-14-19(8-10-32(17,4)21(20)9-11-33(22,23)5)42-31-28(39)26(37)27(38)29(43-31)30(40)41/h15-17,19-21,23,26-29,31,35,37-39H,6-14H2,1-5H3,(H,40,41)

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InChIKey

CFFDFUDCYHFINU-UHFFFAOYSA-N

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PubChem CID

74946499

1 reference

based on heuristic

inferred from InChIKey

(Q104956477)

3,4,5-Trihydroxy-6-[[16-hydroxy-10,13-dimethyl-17-(6-methyl-4-oxoheptan-2-yl)-15-oxo-1,2,3,4,5,6,7,8,9,11,12,14-dodecahydrocyclopenta[a]phenanthren-3-yl]oxy]oxane-2-carboxylic acid

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