(Q105300321)

English

[(1S,2S,6S,7S,9R,11S,13S,14R,15S,16S,17S)-11-hydroxy-4,15-dimethoxy-2,6,14,17-tetramethyl-3-oxo-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-4-en-16-yl] acetate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

Picras-2-en-1-one, 11-(acetyloxy)-16-hydroxy-2,12-dimethoxy-, (11alpha,12beta)-

1 reference

1 reference

436.246103492 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₄H₃₆O₇

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canonical SMILES

O=C(OC1C(OC)C(C)C2CC(O)OC3CC4C(C=C(OC)C(=O)C4(C)C1C32C)C)C

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isomeric SMILES

COC1=C[C@@H](C)[C@@H]2C[C@H]3O[C@H](O)C[C@H]4[C@@H](C)[C@H](OC)[C@@H](OC(C)=O)[C@H]([C@@]2(C)C1=O)[C@]43C

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found in taxon

Picrasma quassioides

2 references

stated in

New Quassinoid Glucosides, Picrasinoside-A, -B, -C, -D, -E, -F, and -G and New Hemiacetals, Picrasinol-A and -B, from the Stem Bark ofPicrasma ailanthoidesPLANCHON

stated in

NEW QUASSINOID GLYCOSIDES AND HEMIACETALS FROMPICRASMA AILANTHOIDESPLANCHON. PICRASINOSIDE-B,-C,-D,-E,-F, AND -G, AND PICRASINOL-A AND -B

Identifiers

InChI

InChI=1S/C24H36O7/c1-11-8-16(28-6)22(27)24(5)14(11)9-17-23(4)15(10-18(26)31-17)12(2)19(29-7)20(21(23)24)30-13(3)25/h8,11-12,14-15,17-21,26H,9-10H2,1-7H3/t11-,12-,14+,15+,17-,18+,19+,20-,21+,23-,24+/m1/s1

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InChIKey

WAMVEYUDRXYJRJ-LQZPOMRHSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

WAMVEYUDRXYJRJ-LQZPOMRHSA-N

(Q105300321)

[(1S,2S,6S,7S,9R,11S,13S,14R,15S,16S,17S)-11-hydroxy-4,15-dimethoxy-2,6,14,17-tetramethyl-3-oxo-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-4-en-16-yl] acetate

Statements

Identifiers

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