(Q105375393)

English

(2E,4E,6E)-N-[1-({15-hydroxy-9,13,16,17-tetramethyl-2,6,12,18-tetraoxo-5-oxa-1,11,14,17-tetraazatricyclo[17.3.0.0⁷,¹¹]docos-14-en-3-yl}-C-hydroxycarbonimidoyl)-2-phenylethyl]octa-2,4,6-trienimidic acid

group of stereoisomers with the chemical formula C₃₈H₅₀N₆O₈

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Statements

instance of

group of stereoisomers

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subclass of

biogenic cyclopeptide

1 reference

inferred from

biogenic cyclopeptide

mass

718.36901256 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₈H₅₀N₆O₈

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canonical SMILES

CC=CC=CC=CC(=O)NC(Cc1ccccc1)C(=O)NC1COC(=O)C2CC(C)CN2C(=O)C(C)NC(=O)C(C)N(C)C(=O)C2CCCN2C1=O

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isomeric SMILES

C/C=C/C=C/C=C/C(=O)NC(Cc1ccccc1)C(=O)NC1COC(=O)C2CC(C)CN2C(=O)C(C)NC(=O)C(C)N(C)C(=O)C2CCCN2C1=O

1 reference

based on heuristic

inferred from InChI

found in taxon

Streptomyces hawaiiensis

1 reference

stated in

Acyl depsipeptide (ADEP) resistance in Streptomyces

Identifiers

InChI

InChI=1S/C38H50N6O8/c1-6-7-8-9-13-18-32(45)40-28(21-27-15-11-10-12-16-27)34(47)41-29-23-52-38(51)31-20-24(2)22-44(31)35(48)25(3)39-33(46)26(4)42(5)37(50)30-17-14-19-43(30)36(29)49/h6-13,15-16,18,24-26,28-31H,14,17,19-23H2,1-5H3,(H,39,46)(H,40,45)(H,41,47)/b7-6+,9-8+,18-13+

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InChIKey

ZGRSXMWWGUOTAO-XBMCTSEYSA-N

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(Q105375393)

(2E,4E,6E)-N-[1-({15-hydroxy-9,13,16,17-tetramethyl-2,6,12,18-tetraoxo-5-oxa-1,11,14,17-tetraazatricyclo[17.3.0.0⁷,¹¹]docos-14-en-3-yl}-C-hydroxycarbonimidoyl)-2-phenylethyl]octa-2,4,6-trienimidic acid

Statements

Identifiers

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