(Q105123427)

English

[(1S,3R,6R,8R,11S,12S,15R,16R)-7,7,12,16-tetramethyl-15-[(2R)-1-[(2R)-4-methyl-5-oxo-2H-furan-2-yl]propan-2-yl]-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl] acetate

chemical compound

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instance of

type of chemical entity

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subclass of

[7,7,12,16-tetramethyl-15-[1-(4-methyl-5-oxo-2H-furan-2-yl)propan-2-yl]-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl] acetate

1 reference

based on heuristic

inferred from SMILES

mass

496.355260016 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₂H₄₈O₄

0 references

canonical SMILES

O=C1OC(C=C1C)CC(C)C2CCC3(C)C4CCC5C(C)(C)C(OC(=O)C)CCC65CC46CCC23C

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isomeric SMILES

CC(=O)O[C@@H]1CC[C@]23C[C@]24CC[C@]2(C)[C@@H]([C@H](C)C[C@@H]5C=C(C)C(=O)O5)CC[C@@]2(C)[C@@H]4CC[C@H]3C1(C)C

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found in taxon

Abies pinsapo subsp. marocana

1 reference

stated in

Terpenoids of the wood of Abies marocana

Identifiers

InChI

InChI=1S/C32H48O4/c1-19(16-22-17-20(2)27(34)36-22)23-10-12-30(7)25-9-8-24-28(4,5)26(35-21(3)33)11-13-31(24)18-32(25,31)15-14-29(23,30)6/h17,19,22-26H,8-16,18H2,1-7H3/t19-,22-,23-,24+,25+,26-,29-,30+,31-,32+/m1/s1

0 references

InChIKey

IZRXVIAJRGQOGL-SKFDEQBGSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

IZRXVIAJRGQOGL-SKFDEQBGSA-N

(Q105123427)

[(1S,3R,6R,8R,11S,12S,15R,16R)-7,7,12,16-tetramethyl-15-[(2R)-1-[(2R)-4-methyl-5-oxo-2H-furan-2-yl]propan-2-yl]-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl] acetate

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