(Q105245849)

English

2-(3-(1-(((4E,10E)-2,9-Dioxo-12-isopropyl-1,8-diazacyclododecane-4,10-diene-3-yl)carbamoyl)-2-methylpropyl)ureido)-3-methylbutyric acid

group of stereoisomers with the chemical formula C₂₄H₃₉N₅O₆

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

493.290033968 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₄H₃₉N₅O₆

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canonical SMILES

CC(C)C1C=CC(=O)NCCC=CC(NC(=O)C(NC(=O)NC(C(=O)O)C(C)C)C(C)C)C(=O)N1

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isomeric SMILES

CC(C)C1/C=C/C(=O)NCC/C=C/C(NC(=O)C(NC(=O)NC(C(=O)O)C(C)C)C(C)C)C(=O)N1

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found in taxon

Pseudomonas syringae

1 reference

stated in

Syringolin, a Novel Peptide Elicitor fromPseudomonas syringaepv.syringaethat Induces Resistance toPyricularia oryzaein Rice

Identifiers

InChI

InChI=1S/C24H39N5O6/c1-13(2)16-10-11-18(30)25-12-8-7-9-17(21(31)26-16)27-22(32)19(14(3)4)28-24(35)29-20(15(5)6)23(33)34/h7,9-11,13-17,19-20H,8,12H2,1-6H3,(H,25,30)(H,26,31)(H,27,32)(H,33,34)(H2,28,29,35)/b9-7+,11-10+

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InChIKey

RUWSLQOIGKYPEZ-RJECPTDASA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

RUWSLQOIGKYPEZ-RJECPTDASA-N

ChEBI ID

181397

mapping relation type

exact match

2 references

stated in

ChEBI release 2022-06-13

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C24H39N5O6/c1-13(2)16-10-11-18(30)25-12-8-7-9-17(21(31)26-16)27-22(32)19(14(3)4)28-24(35)29-20(15(5)6)23(33)34/h7,9-11,13-17,19-20H,8,12H2,1-6H3,(H,25,30)(H,26,31)(H,27,32)(H,33,34)(H2,28,29,35)/b9-7+,11-10+

(Q105245849)

2-(3-(1-(((4E,10E)-2,9-Dioxo-12-isopropyl-1,8-diazacyclododecane-4,10-diene-3-yl)carbamoyl)-2-methylpropyl)ureido)-3-methylbutyric acid

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Identifiers

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