(Q105297623)

English

[3-Acetyloxy-4-(5-acetyloxy-3,4-dimethoxyoxan-2-yl)oxy-5-[2-methyl-6-(3,6,8,15-tetraacetyloxy-10,13-dimethyl-1,2,3,4,5,6,7,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl)heptan-3-yl]oxyoxolan-2-yl]methyl acetate

group of stereoisomers with the chemical formula C₅₃H₈₂O₂₀

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instance of

group of stereoisomers

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1 reference

1,038.539945024 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₅₃H₈₂O₂₀

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canonical SMILES

O=C(OCC1OC(OC(CCC(C)C2CC(OC(=O)C)C3C4(OC(=O)C)CC(OC(=O)C)C5CC(OC(=O)C)CCC5(C)C4CCC23C)C(C)C)C(OC6OCC(OC(=O)C)C(OC)C6OC)C1OC(=O)C)C

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Identifiers

InChI

InChI=1S/C53H82O20/c1-26(2)38(70-50-47(45(69-33(9)59)42(71-50)24-63-28(4)54)72-49-46(62-14)44(61-13)41(25-64-49)68-32(8)58)16-15-27(3)36-22-39(66-30(6)56)48-52(36,12)20-18-43-51(11)19-17-35(65-29(5)55)21-37(51)40(67-31(7)57)23-53(43,48)73-34(10)60/h26-27,35-50H,15-25H2,1-14H3

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InChIKey

VVEQEFFSJQQHCB-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

VVEQEFFSJQQHCB-UHFFFAOYSA-N

(Q105297623)

[3-Acetyloxy-4-(5-acetyloxy-3,4-dimethoxyoxan-2-yl)oxy-5-[2-methyl-6-(3,6,8,15-tetraacetyloxy-10,13-dimethyl-1,2,3,4,5,6,7,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl)heptan-3-yl]oxyoxolan-2-yl]methyl acetate

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