(Q104397382)

English

Maytansine, N2'-deacetyl-15-methoxy-N2'-(2-methyl-1-oxopropyl)-

group of stereoisomers with the chemical formula C₃₇H₅₂ClN₃O₁₁

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instance of

group of stereoisomers

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1 reference

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749.329037164 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₃₇H₅₂ClN₃O₁₁

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canonical SMILES

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

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isomeric SMILES

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

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New cardenolides from the stem bark of Trewia nudiflora

Identifiers

InChI

InChI=1S/C37H52ClN3O11/c1-19(2)33(43)40(7)22(5)34(44)51-28-17-29(42)41(8)24-15-23(16-25(47-9)30(24)38)31(49-11)20(3)13-12-14-27(48-10)37(46)18-26(50-35(45)39-37)21(4)32-36(28,6)52-32/h12-16,19,21-22,26-28,31-32,46H,17-18H2,1-11H3,(H,39,45)/b14-12+,20-13?

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InChIKey

GNTFDQQBHGBGMN-VAIPQXABSA-N

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1 reference

26 December 2021

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(Q104397382)

Maytansine, N2'-deacetyl-15-methoxy-N2'-(2-methyl-1-oxopropyl)-

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