(Q105175987)

English

(1R,3Z,5S,7S,9Z,11S,14S,15R,16S)-16-benzyl-5,7,13,14-tetramethyl-17-azatricyclo[9.7.0.01,15]octadeca-3,9,12-triene-2,6,18-trione

chemical compound

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instance of

type of chemical entity

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subclass of

16-Benzyl-5,7,13,14-tetramethyl-17-azatricyclo[9.7.0.01,15]octadeca-3,9,12-triene-2,6,18-trione

1 reference

based on heuristic

inferred from SMILES

mass

431.246043916 dalton

1 reference

1 reference

C₂₈H₃₃NO₃

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canonical SMILES

CC1=CC2C=CCC(C)C(=O)C(C)C=CC(=O)C23C(=O)NC(Cc2ccccc2)C3C1C

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isomeric SMILES

CC1=C[C@@H]2/C=C\C[C@H](C)C(=O)[C@@H](C)/C=C\C(=O)[C@@]23C(=O)N[C@@H](Cc2ccccc2)[C@@H]3[C@@H]1C

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Identifiers

InChI

InChI=1S/C28H33NO3/c1-17-9-8-12-22-15-19(3)20(4)25-23(16-21-10-6-5-7-11-21)29-27(32)28(22,25)24(30)14-13-18(2)26(17)31/h5-8,10-15,17-18,20,22-23,25H,9,16H2,1-4H3,(H,29,32)/b12-8-,14-13-/t17-,18-,20+,22-,23-,25-,28-/m0/s1

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InChIKey

MZRDRLOYHFZNCS-FSHFVSEHSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

MZRDRLOYHFZNCS-FSHFVSEHSA-N

1 reference

Natural Product Atlas ID

NPA012164

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

MZRDRLOYHFZNCS-FSHFVSEHSA-N

(Q105175987)

(1R,3Z,5S,7S,9Z,11S,14S,15R,16S)-16-benzyl-5,7,13,14-tetramethyl-17-azatricyclo[9.7.0.01,15]octadeca-3,9,12-triene-2,6,18-trione

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