(Q105197104)

English

methyl 2-[(1S,2R,5S,6S,10S,11S,13S,14S,16R)-6-(furan-3-yl)-10-hydroxy-1,5,15,15-tetramethyl-8,17-dioxo-7,18-dioxapentacyclo[11.3.1.111,14.02,11.05,10]octadecan-16-yl]acetate

chemical compound

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type of chemical entity

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1 reference

4H-10,12a-Epoxy-7,11-methano-2H-cycloocta[3,4]benzo[1,2-c]pyran-8-acetic acid, 4-(3-furanyl)dodecahydro-12b-hydroxy-4a,7,9,9-tetramethyl-2,14-dioxo-, methyl ester

1 reference

based on heuristic

inferred from SMILES

mass

486.225368048 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

methyl 2-[(1S,2R,5S,6S,10S,11S,13S,14R,16S)-6-(furan-3-yl)-10-hydroxy-1,5,15,15-tetramethyl-8,17-dioxo-7,18-dioxapentacyclo[11.3.1.111,14.02,11.05,10]octadecan-16-yl]acetate

1 reference

based on heuristic

inferred from InChIKey

methyl 2-[(1S,2R,5S,6S,10S,11S,13R,14R,16S)-6-(furan-3-yl)-10-hydroxy-1,5,15,15-tetramethyl-8,17-dioxo-7,18-dioxapentacyclo[11.3.1.111,14.02,11.05,10]octadecan-16-yl]acetate

1 reference

based on heuristic

inferred from InChI

methyl 2-[(1S,2S,5S,6S,10S,11S,13S,14R,16S)-6-(furan-3-yl)-10-hydroxy-1,5,15,15-tetramethyl-8,17-dioxo-7,18-dioxapentacyclo[11.3.1.111,14.02,11.05,10]octadecan-16-yl]acetate

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₇H₃₄O₈

0 references

canonical SMILES

O=C(OC)CC1C2(C(=O)C3CC4(OC3C1(C)C)C2CCC5(C)C(OC(=O)CC45O)C6=COC=C6)C

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isomeric SMILES

COC(=O)C[C@@H]1C(C)(C)[C@H]2O[C@@]34C[C@@H]2C(=O)[C@]1(C)[C@H]3CC[C@@]1(C)[C@H](c2ccoc2)OC(=O)C[C@]14O

0 references

found in taxon

Cedrela odorata

2 references

stated in

Limonoids from andiroba oil and Cedrela fissilis and their insecticidal activity

stated in

Limonoids from the stem bark of Cedrela odorata

Xylocarpus granatum

4 references

stated in

Protoxylocarpins F-H, protolimonoids from seed kernels of Xylocarpus granatum.

stated in

A limonoid from Xylocarpus granatum

stated in

Protoxylocarpins F-H, protolimonoids from seed kernels of Xylocarpus granatum.

stated in

Xylocarpins A-I, Limonoids from the Chinese Mangrove Plant Xylocarpus granatum

Carapa guianensis

1 reference

stated in

Limonoids from andiroba oil and Cedrela fissilis and their insecticidal activity

Identifiers

InChI

InChI=1S/C27H34O8/c1-23(2)17(10-18(28)32-5)25(4)16-6-8-24(3)21(14-7-9-33-13-14)34-19(29)12-27(24,31)26(16)11-15(20(25)30)22(23)35-26/h7,9,13,15-17,21-22,31H,6,8,10-12H2,1-5H3/t15-,16-,17-,21+,22+,24+,25-,26+,27+/m1/s1

0 references

InChIKey

OQQDWKJSAQRSAX-XTTNDHMJSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

OQQDWKJSAQRSAX-XTTNDHMJSA-N

1 reference

(Q105197104)

methyl 2-[(1S,2R,5S,6S,10S,11S,13S,14S,16R)-6-(furan-3-yl)-10-hydroxy-1,5,15,15-tetramethyl-8,17-dioxo-7,18-dioxapentacyclo[11.3.1.111,14.02,11.05,10]octadecan-16-yl]acetate

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