(Q110197327)

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]-3,5,14-trihydroxy-10,13-dimethyl-1,2,3,4,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-6-one

group of stereoisomers with the chemical formula C₃₉H₆₄O₁₅

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

772.424521348 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₉H₆₄O₁₅

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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)CC16O

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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/C39H64O15/c1-19(21-10-14-38(49)23-15-26(43)39(50)16-20(42)8-12-37(39,5)22(23)9-13-36(21,38)4)7-6-11-35(2,3)54-34-32(30(47)28(45)25(18-41)52-34)53-33-31(48)29(46)27(44)24(17-40)51-33/h15,19-22,24-25,27-34,40-42,44-50H,6-14,16-18H2,1-5H3

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InChIKey

HYPFLSYQWDBEFD-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

HYPFLSYQWDBEFD-UHFFFAOYSA-N

(Q110197327)

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]-3,5,14-trihydroxy-10,13-dimethyl-1,2,3,4,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-6-one

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Identifiers

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