(Q105380400)

English

(11-Chloro-21-hydroxy-12,15,20-trimethoxy-2,5,9,16-tetramethyl-8,23-dioxo-4,24-dioxa-9,22-diazatetracyclo[19.3.1.110,14.03,5]hexacosa-10,12,14(26),16,18-pentaen-6-yl) 2-(2-methylpropanoylamino)propanoate

group of stereoisomers with the chemical formula C₃₆H₅₀ClN₃O₁₁

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instance of

group of stereoisomers

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1 reference

1 reference

735.3133871 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₆H₅₀ClN₃O₁₁

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canonical SMILES

COc1cc2cc(c1Cl)N(C)C(=O)CC(OC(=O)C(C)NC(=O)C(C)C)C1(C)OC1C(C)C1CC(O)(NC(=O)O1)C(OC)C=CC=C(C)C2OC

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found in taxon

Trewia nudiflora

1 reference

stated in

Novel maytansinoid tumor inhibitors from Trewia nudiflora: trewiasine, dehydrotrewiasine, and demethyltrewiasine

Identifiers

InChI

InChI=1S/C36H50ClN3O11/c1-18(2)32(42)38-21(5)33(43)50-27-16-28(41)40(7)23-14-22(15-24(46-8)29(23)37)30(48-10)19(3)12-11-13-26(47-9)36(45)17-25(49-34(44)39-36)20(4)31-35(27,6)51-31/h11-15,18,20-21,25-27,30-31,45H,16-17H2,1-10H3,(H,38,42)(H,39,44)

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InChIKey

ZOEMEKDIPYTCFY-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

ZOEMEKDIPYTCFY-UHFFFAOYSA-N

1 reference

(Q105380400)

(11-Chloro-21-hydroxy-12,15,20-trimethoxy-2,5,9,16-tetramethyl-8,23-dioxo-4,24-dioxa-9,22-diazatetracyclo[19.3.1.110,14.03,5]hexacosa-10,12,14(26),16,18-pentaen-6-yl) 2-(2-methylpropanoylamino)propanoate

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Identifiers

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