(Q105313873)

English

(E)-N-[(3R,4R,7R,10E)-7-[(2S)-butan-2-yl]-5,8-dioxo-3-propan-2-yl-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),10,12,15-tetraen-4-yl]-3-phenylprop-2-enamide

chemical compound

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instance of

type of chemical entity

0 references

subclass of

cinnamoylamide alkaloid

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mass

489.2627566 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₉H₃₅N₃O₄

0 references

canonical SMILES

CCC(C)C1NC(=O)C(NC(=O)C=Cc2ccccc2)C(C(C)C)Oc2ccc(cc2)C=CNC1=O

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isomeric SMILES

CC[C@H](C)[C@H]1NC(=O)[C@H](NC(=O)/C=C/c2ccccc2)[C@@H](C(C)C)Oc2ccc(cc2)/C=C/NC1=O

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found in taxon

Zizyphus lotus

1 reference

stated in

Four cyclopeptide alkaloids from Zizyphus lotus

Identifiers

InChI

InChI=1S/C29H35N3O4/c1-5-20(4)25-28(34)30-18-17-22-11-14-23(15-12-22)36-27(19(2)3)26(29(35)32-25)31-24(33)16-13-21-9-7-6-8-10-21/h6-20,25-27H,5H2,1-4H3,(H,30,34)(H,31,33)(H,32,35)/b16-13+,18-17+/t20-,25+,26+,27+/m0/s1

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InChIKey

WVYPBVOSAZSUAV-DNEIJQSKSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

WVYPBVOSAZSUAV-DNEIJQSKSA-N

1 reference

(Q105313873)

(E)-N-[(3R,4R,7R,10E)-7-[(2S)-butan-2-yl]-5,8-dioxo-3-propan-2-yl-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),10,12,15-tetraen-4-yl]-3-phenylprop-2-enamide

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