(Q105302295)

English

(1S,5E,7R,9S,11E,13S,14S,17S,18S)-18-benzyl-7,14-dihydroxy-7,9,15,16-tetramethyl-2,4-dioxa-19-azatricyclo[11.7.0.01,17]icosa-5,11,15-triene-3,8,20-trione

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

18-Benzyl-7,14-dihydroxy-7,9,15,16-tetramethyl-2,4-dioxa-19-azatricyclo[11.7.0.01,17]icosa-5,11,15-triene-3,8,20-trione

1 reference

based on heuristic

inferred from SMILES

(5E,11E)-18-benzyl-7,14-dihydroxy-7,9,15,16-tetramethyl-2,4-dioxa-19-azatricyclo[11.7.0.01,17]icosa-5,11,15-triene-3,8,20-trione

1 reference

based on heuristic

inferred from SMILES

mass

495.225702396 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1S,5E,7R,9S,11E,13S,14R,17R,18S)-18-benzyl-7,14-dihydroxy-7,9,15,16-tetramethyl-2,4-dioxa-19-azatricyclo[11.7.0.01,17]icosa-5,11,15-triene-3,8,20-trione

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₈H₃₃NO₇

0 references

canonical SMILES

CC1=C(C)C2C(Cc3ccccc3)NC(=O)C23OC(=O)OC=CC(C)(O)C(=O)C(C)CC=CC3C1O

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isomeric SMILES

CC1=C(C)[C@H]2[C@H](Cc3ccccc3)NC(=O)[C@]23OC(=O)O/C=C/[C@@](C)(O)C(=O)[C@@H](C)C/C=C/[C@H]3[C@@H]1O

0 references

found in taxon

Aspergillus terreus

1 reference

stated in

Bioactive alkaloids from the plant endophytic fungus Aspergillus terreus

Mariannaea elegans

1 reference

stated in

10-Phenyl-[12]-cytochalasins Z7, Z8, and Z9 from the marine-derived fungus Spicaria elegans.

Identifiers

InChI

InChI=1S/C28H33NO7/c1-16-9-8-12-20-23(30)18(3)17(2)22-21(15-19-10-6-5-7-11-19)29-25(32)28(20,22)36-26(33)35-14-13-27(4,34)24(16)31/h5-8,10-14,16,20-23,30,34H,9,15H2,1-4H3,(H,29,32)/b12-8+,14-13+/t16-,20-,21-,22-,23+,27+,28+/m0/s1

0 references

InChIKey

WDDZJZXADGVZLS-LDTGXJKGSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

WDDZJZXADGVZLS-LDTGXJKGSA-N

1 reference

(Q105302295)

(1S,5E,7R,9S,11E,13S,14S,17S,18S)-18-benzyl-7,14-dihydroxy-7,9,15,16-tetramethyl-2,4-dioxa-19-azatricyclo[11.7.0.01,17]icosa-5,11,15-triene-3,8,20-trione

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