(Q104999542)

English

(3,4,6,11-Tetraacetyloxy-2-hydroxy-1,5,15-trimethyl-9-methylidene-14-oxo-16-oxatetracyclo[10.5.0.02,15.05,10]heptadecan-8-yl) 3-phenylprop-2-enoate

group of stereoisomers with the chemical formula C₃₇H₄₄O₁₃

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Statements

instance of

group of stereoisomers

0 references

1 reference

696.278191468 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₃₇H₄₄O₁₃

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canonical SMILES

O=C(OC1C(=C)C2C(OC(=O)C)C3CC(=O)C4(OCC3(C)C4(O)C(OC(=O)C)C(OC(=O)C)C2(C)C(OC(=O)C)C1)C)C=CC=5C=CC=CC5

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found in taxon

Taxus canadensis

2 references

stated in

Isolation and semi-synthesis of a bioactive taxane from Taxus canadensis.

stated in

Taxuspines E ∼ H and J, new taxoids from the Japanese yew Taxus cuspidata

Taxus baccata

1 reference

stated in

Taxuspines E ∼ H and J, new taxoids from the Japanese yew Taxus cuspidata

Taxus wallichiana var. wallichiana

1 reference

stated in

A taxane-11,12-oxide from Taxus yunnanensis

Taxus cuspidata

1 reference

stated in

Bioactive Taxoids from Japanese Yew Taxus cuspidata and Taxol Biosynthesis

Identifiers

InChI

InChI=1S/C37H44O13/c1-19-26(50-29(43)15-14-24-12-10-9-11-13-24)17-28(46-20(2)38)35(7)30(19)31(47-21(3)39)25-16-27(42)36(8)37(44,34(25,6)18-45-36)33(49-23(5)41)32(35)48-22(4)40/h9-15,25-26,28,30-33,44H,1,16-18H2,2-8H3

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InChIKey

FQCUWQFKTUBVLA-UHFFFAOYSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

FQCUWQFKTUBVLA-UHFFFAOYSA-N

1 reference

(Q104999542)

(3,4,6,11-Tetraacetyloxy-2-hydroxy-1,5,15-trimethyl-9-methylidene-14-oxo-16-oxatetracyclo[10.5.0.02,15.05,10]heptadecan-8-yl) 3-phenylprop-2-enoate

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