(Q105206824)

English

2-[(2-{[4,7-dihydroxy-5a,5b,8,8,11a,13b-hexamethyl-3-(2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-2-yl)-hexadecahydrocyclopenta[a]chrysen-9-yl]oxy}-4,5-dihydroxyoxan-3-yl)oxy]-6-methyloxane-3,4,5-triol

group of stereoisomers with the chemical formula C₄₇H₈₀O₁₇

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instance of

group of stereoisomers

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1 reference

917.1297 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₄₇H₈₀O₁₇

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canonical SMILES

OCC1OC(OC(C)(C)C2CCC3(C)C2C(O)CC4(C)C3CCC5C6(C)CCC(OC7OCC(O)C(O)C7OC8OC(C)C(O)C(O)C8O)C(C)(C)C6C(O)CC54C)C(O)C(O)C1O

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Identifiers

InChI

InChI=1S/C47H80O17/c1-20-30(52)33(55)35(57)39(60-20)63-37-31(53)24(51)19-59-41(37)62-28-13-15-45(7)27-11-10-26-44(6)14-12-21(43(4,5)64-40-36(58)34(56)32(54)25(18-48)61-40)29(44)22(49)16-46(26,8)47(27,9)17-23(50)38(45)42(28,2)3/h20-41,48-58H,10-19H2,1-9H3

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InChIKey

PDYIYMDSEUXDKP-UHFFFAOYSA-N

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PubChem CID

73804550

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

PDYIYMDSEUXDKP-UHFFFAOYSA-N

(Q105206824)

2-[(2-{[4,7-dihydroxy-5a,5b,8,8,11a,13b-hexamethyl-3-(2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-2-yl)-hexadecahydrocyclopenta[a]chrysen-9-yl]oxy}-4,5-dihydroxyoxan-3-yl)oxy]-6-methyloxane-3,4,5-triol

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