(Q105189915)

English

(1S,2S,7R,9R,13R,14S,15S,16S,17S)-13,16-dihydroxy-4,15-dimethoxy-2,14,17-trimethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-4-ene-3,11-dione

chemical compound

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instance of

type of chemical entity

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subclass of

13,16-Dihydroxy-4,15-dimethoxy-2,14,17-trimethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-4-ene-3,11-dione

1 reference

based on heuristic

inferred from SMILES

mass

394.1991533 dalton

1 reference

1 reference

C₂₁H₃₀O₇

0 references

canonical SMILES

O=C1OC2CC3CC=C(OC)C(=O)C3(C)C4C(O)C(OC)C(C)C(O)(C1)C24C

0 references

isomeric SMILES

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

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found in taxon

Picrasma javanica

1 reference

stated in

Javanicins N,P and Q, new quassinoids from Picrasma javanica

Identifiers

InChI

InChI=1S/C21H30O7/c1-10-16(27-5)15(23)17-19(2)11(6-7-12(26-4)18(19)24)8-13-20(17,3)21(10,25)9-14(22)28-13/h7,10-11,13,15-17,23,25H,6,8-9H2,1-5H3/t10-,11+,13+,15+,16-,17+,19-,20+,21+/m0/s1

0 references

InChIKey

ODMCTGSKLFEEBT-ZZQLYNHSSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

ODMCTGSKLFEEBT-ZZQLYNHSSA-N

(Q105189915)

(1S,2S,7R,9R,13R,14S,15S,16S,17S)-13,16-dihydroxy-4,15-dimethoxy-2,14,17-trimethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-4-ene-3,11-dione

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Identifiers

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