(Q105301101)

English

(3R,6S,9S,13R)-6,9-dibenzyl-3-[(2S)-butan-2-yl]-13-[(2S)-octan-2-yl]-1-oxa-4,7,10-triazacyclotridecane-2,5,8,11-tetrone

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

6,9-Dibenzyl-3-butan-2-yl-13-octan-2-yl-1-oxa-4,7,10-triazacyclotridecane-2,5,8,11-tetrone

1 reference

based on heuristic

inferred from SMILES

mass

591.367221668 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₅H₄₉N₃O₅

0 references

canonical SMILES

CCCCCCC(C)C1CC(=O)NC(Cc2ccccc2)C(=O)NC(Cc2ccccc2)C(=O)NC(C(C)CC)C(=O)O1

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isomeric SMILES

CCCCCC[C@H](C)[C@H]1CC(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H]([C@@H](C)CC)C(=O)O1

0 references

found in taxon

Beauveria bassiana

1 reference

stated in

Cyclodepsipeptides from Beauveria bassiana. Part 2. Beauverolides A to F and their relationship to isarolide

Identifiers

InChI

InChI=1S/C35H49N3O5/c1-5-7-8-11-16-25(4)30-23-31(39)36-28(21-26-17-12-9-13-18-26)33(40)37-29(22-27-19-14-10-15-20-27)34(41)38-32(24(3)6-2)35(42)43-30/h9-10,12-15,17-20,24-25,28-30,32H,5-8,11,16,21-23H2,1-4H3,(H,36,39)(H,37,40)(H,38,41)/t24-,25-,28-,29-,30+,32+/m0/s1

0 references

InChIKey

WBVNIXQEIJHNJC-ZWOIWHCGSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

WBVNIXQEIJHNJC-ZWOIWHCGSA-N

(Q105301101)

(3R,6S,9S,13R)-6,9-dibenzyl-3-[(2S)-butan-2-yl]-13-[(2S)-octan-2-yl]-1-oxa-4,7,10-triazacyclotridecane-2,5,8,11-tetrone

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Identifiers

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