(Q105129042)

English

methyl (14E)-14-ethylidene-6-methoxy-2-methyl-19-[(3,4,5-trimethoxybenzoyloxy)methyl]-18-oxa-2,12-diazahexacyclo[9.6.1.1⁹,¹⁵.0¹,⁹.0³,⁸.0¹²,¹⁷]nonadeca-3,5,7-triene-19-carboxylate

group of stereoisomers with the chemical formula C₃₃H₃₈N₂O₉

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instance of

group of stereoisomers

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1 reference

606.257730796 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₃₃H₃₈N₂O₉

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canonical SMILES

O=C(OCC1(C(=O)OC)C2C(=CC)CN3C4OC5(N(C6=CC=C(OC)C=C6C51C4)C)C3C2)C7=CC(OC)=C(OC)C(OC)=C7

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isomeric SMILES

C/C=C1/CN2C3CC45c6cc(OC)ccc6N(C)C4(O3)C2CC1C5(COC(=O)c1cc(OC)c(OC)c(OC)c1)C(=O)OC

1 reference

based on heuristic

inferred from InChI

Identifiers

InChI

InChI=1S/C33H38N2O9/c1-8-18-16-35-26-14-21(18)31(30(37)42-7,17-43-29(36)19-11-24(39-4)28(41-6)25(12-19)40-5)32-15-27(35)44-33(26,32)34(2)23-10-9-20(38-3)13-22(23)32/h8-13,21,26-27H,14-17H2,1-7H3/b18-8-

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InChIKey

JIGZBLWURVFVNC-LSCVHKIXSA-N

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1 reference

17 September 2022

inferred from InChIKey

(Q105129042)

methyl (14E)-14-ethylidene-6-methoxy-2-methyl-19-[(3,4,5-trimethoxybenzoyloxy)methyl]-18-oxa-2,12-diazahexacyclo[9.6.1.1⁹,¹⁵.0¹,⁹.0³,⁸.0¹²,¹⁷]nonadeca-3,5,7-triene-19-carboxylate

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