(Q118469302)

English

21-Benzyl-24-butan-2-yl-4,14-dimethyl-3-oxa-16,26-dithia-7,13,20,23,28,29,30-heptazapentacyclo[23.2.1.12,5.115,18.07,11]triaconta-1(27),2(30),15(29),17,25(28)-pentaene-6,12,19,22-tetrone

group of stereoisomers with the chemical formula C₃₃H₃₉N₇O₅S₂

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

677.245409348 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₃H₃₉N₇O₅S₂

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canonical SMILES

O=C1NC(C(=O)NC(C2=NC(=CS2)C3=NC(C(=O)N4CCCC4C(=O)NC(C5=NC1=CS5)C)C(O3)C)C(C)CC)CC=6C=CC=CC6

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found in taxon

Prochloron

2 references

stated in

Ulicyclamide and ulithiacyclamide, two new small peptides from a marine tunicate

stated in

Cyclic peptide structures from the tunicate Lissoclinum patella by FAB mass spectrometry

Identifiers

InChI

InChI=1S/C33H39N7O5S2/c1-5-17(2)25-32-37-23(16-47-32)30-39-26(19(4)45-30)33(44)40-13-9-12-24(40)29(43)34-18(3)31-36-22(15-46-31)28(42)35-21(27(41)38-25)14-20-10-7-6-8-11-20/h6-8,10-11,15-19,21,24-26H,5,9,12-14H2,1-4H3,(H,34,43)(H,35,42)(H,38,41)

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InChIKey

ABGWWXGWIGDCFQ-UHFFFAOYSA-N

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2 references

18 May 2023

inferred from InChIKey

matched by identifier from

InChIKey

ABGWWXGWIGDCFQ-UHFFFAOYSA-N

1 reference

(Q118469302)

21-Benzyl-24-butan-2-yl-4,14-dimethyl-3-oxa-16,26-dithia-7,13,20,23,28,29,30-heptazapentacyclo[23.2.1.12,5.115,18.07,11]triaconta-1(27),2(30),15(29),17,25(28)-pentaene-6,12,19,22-tetrone

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Identifiers

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