(Q110193417)

English

17-[6-[4,5-dihydroxy-6-(hydroxymethyl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-6-methylheptan-2-yl]-3,14-dihydroxy-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 C₃₉H₆₄O₁₄

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

756.429606728 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₉H₆₄O₁₄

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canonical SMILES

O=C1C=C2C(CCC3(C)C(CCC23O)C(C)CCCC(OC4OC(CO)C(O)C(O)C4OC5OC(CO)C(O)C(O)C5O)(C)C)C6(C)CCC(O)CC16

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found in taxon

Froelichia floridana

1 reference

stated in

Ecdysteroids and a sucrose phenylpropanoid ester from Froelichia floridana

Identifiers

InChI

InChI=1S/C39H64O14/c1-19(21-10-14-39(49)23-16-25(43)24-15-20(42)8-12-37(24,4)22(23)9-13-38(21,39)5)7-6-11-36(2,3)53-35-33(31(47)29(45)27(18-41)51-35)52-34-32(48)30(46)28(44)26(17-40)50-34/h16,19-22,24,26-35,40-42,44-49H,6-15,17-18H2,1-5H3

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InChIKey

SVMJZCACKKJCOO-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

SVMJZCACKKJCOO-UHFFFAOYSA-N

(Q110193417)

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

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Identifiers

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