(Q115947007)

English

(2,7,9,10,13-Pentaacetyloxy-1-hydroxy-8,12,15,15-tetramethyl-4-methylidene-5-tricyclo[9.3.1.03,8]pentadec-11-enyl) 3-(dimethylamino)-2-hydroxy-3-phenylpropanoate

group of stereoisomers with the chemical formula C₄₁H₅₅NO₁₄

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

785.36225544 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₄₁H₅₅NO₁₄

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canonical SMILES

O=C(OC1C(=C2C(OC(=O)C)C(OC(=O)C)C3(C)C(OC(=O)C)CC(OC(=O)C(O)C(C=4C=CC=CC4)N(C)C)C(=C)C3C(OC(=O)C)C(O)(C1)C2(C)C)C)C

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found in taxon

Taxus baccata

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stated in

New taxoids fromTaxus baccata L.

Identifiers

InChI

InChI=1S/C41H55NO14/c1-20-28(56-38(49)34(48)33(42(11)12)27-16-14-13-15-17-27)18-30(52-23(4)44)40(10)32(20)36(54-25(6)46)41(50)19-29(51-22(3)43)21(2)31(39(41,8)9)35(53-24(5)45)37(40)55-26(7)47/h13-17,28-30,32-37,48,50H,1,18-19H2,2-12H3

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InChIKey

KPOWRRDYXUYBJR-UHFFFAOYSA-N

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2 references

2 January 2023

inferred from InChIKey

matched by identifier from

InChIKey

KPOWRRDYXUYBJR-UHFFFAOYSA-N

(Q115947007)

(2,7,9,10,13-Pentaacetyloxy-1-hydroxy-8,12,15,15-tetramethyl-4-methylidene-5-tricyclo[9.3.1.03,8]pentadec-11-enyl) 3-(dimethylamino)-2-hydroxy-3-phenylpropanoate

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Identifiers

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