(Q105174708)

English

8-Benzyl-22-butan-2-yl-15,26-dimethyl-27-oxa-13,20-dithia-6,9,16,23,28,29,30-heptazapentacyclo[23.2.1.111,14.118,21.02,6]triaconta-1(28),11,14(30),21(29)-tetraene-7,10,17,24-tetrone

group of stereoisomers with the chemical formula C₃₃H₄₁N₇O₅S₂

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Statements

instance of

group of stereoisomers

0 references

1 reference

679.261059412 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₃H₄₁N₇O₅S₂

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canonical SMILES

CCC(C)C1NC(=O)C2N=C(OC2C)C2CCCN2C(=O)C(Cc2ccccc2)NC(=O)c2csc(n2)C(C)NC(=O)C2CSC1=N2

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found in taxon

Prochloron

2 references

stated in

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

stated in

Cyclic peptides from the ascidian Lissoclinum patella: conformational analysis of patellamide D by x-ray analysis and molecular modeling

Identifiers

InChI

InChI=1S/C33H41N7O5S2/c1-5-17(2)25-32-37-22(16-47-32)27(41)34-18(3)31-36-23(15-46-31)28(42)35-21(14-20-10-7-6-8-11-20)33(44)40-13-9-12-24(40)30-39-26(19(4)45-30)29(43)38-25/h6-8,10-11,15,17-19,21-22,24-26H,5,9,12-14,16H2,1-4H3,(H,34,41)(H,35,42)(H,38,43)

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InChIKey

MXZCBFXSFNFJTR-UHFFFAOYSA-N

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2 references

18 May 2023

inferred from InChIKey

matched by identifier from

InChIKey

MXZCBFXSFNFJTR-UHFFFAOYSA-N

1 reference

(Q105174708)

8-Benzyl-22-butan-2-yl-15,26-dimethyl-27-oxa-13,20-dithia-6,9,16,23,28,29,30-heptazapentacyclo[23.2.1.111,14.118,21.02,6]triaconta-1(28),11,14(30),21(29)-tetraene-7,10,17,24-tetrone

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Identifiers

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