(Q105290375)

English

[4-Acetyloxy-5-hydroxy-6-[[2-(hydroxymethyl)-10-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[4.4.0.02,4]dec-7-en-5-yl]oxy]-2-methyloxan-3-yl] 3-(4-methoxyphenyl)prop-2-enoate

group of stereoisomers with the chemical formula C₃₃H₄₂O₁₇

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Statements

instance of

group of stereoisomers

0 references

1 reference

710.2421998840001 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₃H₄₂O₁₇

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canonical SMILES

O=C(OC1C(OC(OC2C3OC3(CO)C4C(OC=CC24)OC5OC(CO)C(O)C(O)C5O)C(O)C1OC(=O)C)C)C=CC6=CC=C(OC)C=C6

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found in taxon

Buddleja officinalis

1 reference

stated in

Terpenoids in Buddleja: relevance to chemosystematics, chemical ecology and biological activity

Identifiers

InChI

InChI=1S/C33H42O17/c1-14-26(47-20(37)9-6-16-4-7-17(42-3)8-5-16)28(45-15(2)36)25(41)32(44-14)48-27-18-10-11-43-30(21(18)33(13-35)29(27)50-33)49-31-24(40)23(39)22(38)19(12-34)46-31/h4-11,14,18-19,21-32,34-35,38-41H,12-13H2,1-3H3

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InChIKey

VORMEQNHMJOLMM-UHFFFAOYSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

VORMEQNHMJOLMM-UHFFFAOYSA-N

(Q105290375)

[4-Acetyloxy-5-hydroxy-6-[[2-(hydroxymethyl)-10-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[4.4.0.02,4]dec-7-en-5-yl]oxy]-2-methyloxan-3-yl] 3-(4-methoxyphenyl)prop-2-enoate

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