(Q105143462)

English

8-[4,5-dihydroxy-3-[2,3,5-trihydroxy-6-(hydroxymethyl)oxan-4-yl]oxyoxan-2-yl]oxy-12-hydroxy-4a,4b,7,7,10a-pentamethyl-2-(3-methyl-4-oxopentyl)-4,5,6,6a,8,9,10,10b,11,12-decahydro-3H-chrysene-2-carboxylic acid

group of stereoisomers with the chemical formula C₄₁H₆₆O₁₄

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

782.4452567920004 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₄₁H₆₆O₁₄

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canonical SMILES

O=C(O)C1(C=C2C(O)CC3C4(C)CCC(OC5OCC(O)C(O)C5OC6C(O)C(O)OC(CO)C6O)C(C)(C)C4CCC3(C)C2(C)CC1)CCC(C(=O)C)C

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Identifiers

InChI

InChI=1S/C41H66O14/c1-20(21(2)43)8-13-41(36(50)51)15-14-39(6)22(17-41)23(44)16-27-38(5)11-10-28(37(3,4)26(38)9-12-40(27,39)7)54-35-33(29(46)24(45)19-52-35)55-32-30(47)25(18-42)53-34(49)31(32)48/h17,20,23-35,42,44-49H,8-16,18-19H2,1-7H3,(H,50,51)

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InChIKey

KNLRZNIMDCZDFY-UHFFFAOYSA-N

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PubChem CID

163017989

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

KNLRZNIMDCZDFY-UHFFFAOYSA-N

(Q105143462)

8-[4,5-dihydroxy-3-[2,3,5-trihydroxy-6-(hydroxymethyl)oxan-4-yl]oxyoxan-2-yl]oxy-12-hydroxy-4a,4b,7,7,10a-pentamethyl-2-(3-methyl-4-oxopentyl)-4,5,6,6a,8,9,10,10b,11,12-decahydro-3H-chrysene-2-carboxylic acid

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