(Q118469292)

English

(1R,8R,11S,14R,21R,24S)-11,24-bis[(1S)-1-hydroxyethyl]-8,21-bis(2-methylpropyl)-6,19,28,29-tetrathia-2,9,12,15,22,25,31,32-octazatetracyclo[12.12.4.14,7.117,20]dotriaconta-4,7(32),17,20(31)-tetraene-3,10,13,16,23,26-hexone

chemical compound

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instance of

type of chemical entity

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subclass of

chemical compound

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mass

798.232144432 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₂H₄₆N₈O₈S₄

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canonical SMILES

O=C1NC2C(=O)NC(C(=O)NC(C3=NC(=CS3)C(=O)NC(C(=O)NC(C(=O)NC(C4=NC1=CS4)CC(C)C)C(O)C)CSSC2)CC(C)C)C(O)C

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isomeric SMILES

CC(C)C[C@H]1NC(=O)[C@H]([C@H](C)O)NC(=O)[C@@H]2CSSC[C@H](NC(=O)c3csc1n3)C(=O)N[C@@H]([C@H](C)O)C(=O)N[C@H](CC(C)C)c1nc(cs1)C(=O)N2

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found in taxon

Prochloron

1 reference

stated in

Preulithiacyclamide, a New Cyclic Peptide from the AscidianLissoclinum patella

Identifiers

InChI

InChI=1S/C32H46N8O8S4/c1-13(2)7-17-31-37-19(9-49-31)25(43)35-22-12-52-51-11-21(27(45)39-23(15(5)41)29(47)33-17)36-26(44)20-10-50-32(38-20)18(8-14(3)4)34-30(48)24(16(6)42)40-28(22)46/h9-10,13-18,21-24,41-42H,7-8,11-12H2,1-6H3,(H,33,47)(H,34,48)(H,35,43)(H,36,44)(H,39,45)(H,40,46)/t15-,16-,17+,18+,21-,22-,23-,24-/m0/s1

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InChIKey

MASBANRVOBJFHH-NMJMRQOTSA-N

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2 references

18 May 2023

inferred from InChIKey

matched by identifier from

InChIKey

MASBANRVOBJFHH-NMJMRQOTSA-N

1 reference

(Q118469292)

(1R,8R,11S,14R,21R,24S)-11,24-bis[(1S)-1-hydroxyethyl]-8,21-bis(2-methylpropyl)-6,19,28,29-tetrathia-2,9,12,15,22,25,31,32-octazatetracyclo[12.12.4.14,7.117,20]dotriaconta-4,7(32),17,20(31)-tetraene-3,10,13,16,23,26-hexone

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Identifiers

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