(Q105371234)

English

methyl (1R,2S,4S,7S,9S,10S,12S,15S)-2-acetyloxy-7-(furan-3-yl)-4-hydroxy-9-methyl-5,14-dioxo-6,13-dioxatetracyclo[10.2.2.01,10.04,9]hexadecane-15-carboxylate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

Methyl 2-acetyloxy-7-(furan-3-yl)-4-hydroxy-9-methyl-5,14-dioxo-6,13-dioxatetracyclo[10.2.2.01,10.04,9]hexadecane-15-carboxylate

1 reference

based on heuristic

inferred from SMILES

mass

462.152597032 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₃H₂₆O₁₀

0 references

canonical SMILES

O=C(OC1CC2(O)C(=O)OC(C3=COC=C3)CC2(C)C4CC5OC(=O)C14C(C(=O)OC)C5)C

0 references

isomeric SMILES

COC(=O)[C@H]1C[C@@H]2C[C@H]3[C@]4(C)C[C@@H](c5ccoc5)OC(=O)[C@]4(O)C[C@H](OC(C)=O)[C@]13C(=O)O2

0 references

found in taxon

Dioscorea bulbifera

1 reference

stated in

Bafoudiosbulbins F and G, further clerodane diterpenoids from Dioscorea bulbifera L. var sativa and revised structure of Bafoudiosbulbin B

Identifiers

InChI

InChI=1S/C23H26O10/c1-11(24)31-17-9-22(28)19(26)33-15(12-4-5-30-10-12)8-21(22,2)16-7-13-6-14(18(25)29-3)23(16,17)20(27)32-13/h4-5,10,13-17,28H,6-9H2,1-3H3/t13-,14-,15+,16+,17+,21+,22-,23+/m1/s1

0 references

InChIKey

ZCLDOCOCRYIXPM-FBYGNPFPSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

ZCLDOCOCRYIXPM-FBYGNPFPSA-N

(Q105371234)

methyl (1R,2S,4S,7S,9S,10S,12S,15S)-2-acetyloxy-7-(furan-3-yl)-4-hydroxy-9-methyl-5,14-dioxo-6,13-dioxatetracyclo[10.2.2.01,10.04,9]hexadecane-15-carboxylate

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Identifiers

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