(Q105015585)

English

[6-[[17-(5,6-dimethylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxyoxan-2-yl]methyl octadeca-9,12-dienoate

group of stereoisomers with the chemical formula C₅₂H₈₈O₇

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instance of

group of stereoisomers

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1 reference

824.653005156 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₅₂H₈₈O₇

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canonical SMILES

O=C(OCC1OC(OC2CC3=CCC4C(CCC5(C)C(CCC45)C(C)CCC(C)C(C)C)C3(C)CC2)C(O)C(O)C1O)CCCCCCCC=CCC=CCCCCC

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Identifiers

InChI

InChI=1S/C52H88O7/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-46(53)57-35-45-47(54)48(55)49(56)50(59-45)58-40-30-32-51(6)39(34-40)26-27-41-43-29-28-42(52(43,7)33-31-44(41)51)38(5)25-24-37(4)36(2)3/h12-13,15-16,26,36-38,40-45,47-50,54-56H,8-11,14,17-25,27-35H2,1-7H3

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InChIKey

GQUUYRBGRSKWNI-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

GQUUYRBGRSKWNI-UHFFFAOYSA-N

(Q105015585)

[6-[[17-(5,6-dimethylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxyoxan-2-yl]methyl octadeca-9,12-dienoate

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