(Q105212383)

English

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

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

11,14,16-trihydroxy-4,15-dimethoxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadec-4-en-3-one

1 reference

based on heuristic

inferred from SMILES

mass

410.230453428 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₃₄O₇

0 references

canonical SMILES

O=C1C(OC)=CC(C)C2CC3OC(O)CC4C(O)(C)C(OC)C(O)C(C12C)C34C

0 references

isomeric SMILES

COC1=C[C@@H](C)[C@@H]2C[C@H]3O[C@H](O)C[C@H]4[C@](C)(O)[C@H](OC)[C@@H](O)[C@H]([C@@]2(C)C1=O)[C@@]34C

0 references

found in taxon

Picrasma quassioides

3 references

stated in

Picrasinol D, a New Quassinoid from the Stem Wood of Picrasma ailanthoides

stated in

Bitter Principles ofPicrasma ailanthoidesPlanchon. Nigakihemiacetals A and B, and Nigakilactones G and H.

stated in

Bitter principles of Picrasma ailanthoides Planchon

Identifiers

InChI

InChI=1S/C22H34O7/c1-10-7-12(27-5)18(25)20(2)11(10)8-14-21(3)13(9-15(23)29-14)22(4,26)19(28-6)16(24)17(20)21/h7,10-11,13-17,19,23-24,26H,8-9H2,1-6H3/t10-,11+,13-,14-,15+,16+,17-,19-,20+,21-,22+/m1/s1

0 references

InChIKey

POGHHDUAPIJTLG-ZAWGXVLFSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

POGHHDUAPIJTLG-ZAWGXVLFSA-N

(Q105212383)

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

Statements

Identifiers

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