(Q104193613)

English

17-(2,3-dihydroxy-6-methyl-5-methylideneheptan-2-yl)-2,3,14-trihydroxy-10,13-dimethyl-2,3,4,5,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-6-one

group of stereoisomers with the chemical formula C₂₈H₄₄O₆

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instance of

group of stereoisomers

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1 reference

476.3137891279998 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₈H₄₄O₆

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canonical SMILES

O=C1C=C2C(CCC3(C)C(CCC23O)C(O)(C)C(O)CC(=C)C(C)C)C4(C)CC(O)C(O)CC14

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Identifiers

InChI

InChI=1S/C28H44O6/c1-15(2)16(3)11-24(32)27(6,33)23-8-10-28(34)18-12-20(29)19-13-21(30)22(31)14-25(19,4)17(18)7-9-26(23,28)5/h12,15,17,19,21-24,30-34H,3,7-11,13-14H2,1-2,4-6H3

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InChIKey

OQDKHYZVFZGSRC-UHFFFAOYSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

OQDKHYZVFZGSRC-UHFFFAOYSA-N

1 reference

Human Metabolome Database ID

HMDB0038496

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

OQDKHYZVFZGSRC-UHFFFAOYSA-N

(Q104193613)

17-(2,3-dihydroxy-6-methyl-5-methylideneheptan-2-yl)-2,3,14-trihydroxy-10,13-dimethyl-2,3,4,5,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-6-one

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