(Q105148533)

English

[5-Acetyloxy-4-benzoyloxy-12-(furan-2-carbonyloxy)-2-hydroxy-2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.01,6]dodecan-7-yl] furan-2-carboxylate

group of stereoisomers with the chemical formula C₃₄H₃₆O₁₂

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Statements

instance of

group of stereoisomers

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subclass of

eudesmane sesquiterpenoid

1 reference

inferred from

eudesmane sesquiterpenoid

mass

636.220676592 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₄H₃₆O₁₂

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canonical SMILES

O=C(OC1CC2C(OC(=O)C=3OC=CC3)C4(OC2(C)C)C(O)(C)CC(OC(=O)C=5C=CC=CC5)C(OC(=O)C)C14C)C=6OC=CC6

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Identifiers

InChI

InChI=1S/C34H36O12/c1-19(35)42-27-24(43-28(36)20-11-7-6-8-12-20)18-32(4,39)34-26(45-30(38)23-14-10-16-41-23)21(31(2,3)46-34)17-25(33(27,34)5)44-29(37)22-13-9-15-40-22/h6-16,21,24-27,39H,17-18H2,1-5H3

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InChIKey

LAADBCXDDPNBAA-UHFFFAOYSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

LAADBCXDDPNBAA-UHFFFAOYSA-N

(Q105148533)

[5-Acetyloxy-4-benzoyloxy-12-(furan-2-carbonyloxy)-2-hydroxy-2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.01,6]dodecan-7-yl] furan-2-carboxylate

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Identifiers

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