(Q104986122)

English

[20,22-Diacetyloxy-21-(acetyloxymethyl)-15,25,26-trihydroxy-3,15,26-trimethyl-6,16,23-trioxo-2,5,17-trioxa-11-azapentacyclo[16.7.1.01,21.03,24.07,12]hexacosa-7(12),8,10-trien-19-yl] benzoate

group of stereoisomers with the chemical formula C₃₉H₄₃NO₁₇

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instance of

group of stereoisomers

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subclass of

eudesmane sesquiterpenoid

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inferred from

eudesmane sesquiterpenoid

1 reference

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797.2530989160005 dalton

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based on heuristic

inferred from InChI

chemical formula

C₃₉H₄₃NO₁₇

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canonical SMILES

O=C1OCC2(OC34C(O)C2C(=O)C(OC(=O)C)C4(COC(=O)C)C(OC(=O)C)C(OC(=O)C=5C=CC=CC5)C(OC(=O)C(O)(C)CCC6=NC=CC=C16)C3(O)C)C

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Identifiers

InChI

InChI=1S/C39H43NO17/c1-19(41)51-18-38-29(53-20(2)42)26(44)25-28(45)39(38)37(6,50)30(27(31(38)54-21(3)43)55-32(46)22-11-8-7-9-12-22)56-34(48)35(4,49)15-14-24-23(13-10-16-40-24)33(47)52-17-36(25,5)57-39/h7-13,16,25,27-31,45,49-50H,14-15,17-18H2,1-6H3

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InChIKey

DOPLLASTCBXBIS-UHFFFAOYSA-N

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PubChem CID

162919529

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

DOPLLASTCBXBIS-UHFFFAOYSA-N

(Q104986122)

[20,22-Diacetyloxy-21-(acetyloxymethyl)-15,25,26-trihydroxy-3,15,26-trimethyl-6,16,23-trioxo-2,5,17-trioxa-11-azapentacyclo[16.7.1.01,21.03,24.07,12]hexacosa-7(12),8,10-trien-19-yl] benzoate

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