(Q118469309)

English

Cyclo[L-Ala-L-Pro-[2-[(R)-alpha-amino*phenethyl]-2-thiazoline-4alpha-ylcarbonyl]-O-(1,1-dimethyl-2-propenyl)-L-Thr-O-(1,1-dimethyl-2-propenyl)-L-Ser-L-Ile-]

chemical compound

In more languages

Statements

type of chemical entity

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chemical compound

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837.445882976 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

1 reference

based on heuristic

inferred from InChI

chemical formula

C₄₃H₆₃N₇O₈S

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canonical SMILES

O=C1NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N2CCCC2C(=O)NC(C3=NC1CS3)CC=4C=CC=CC4)C)C(C)CC)COC(C=C)(C)C)C(OC(C=C)(C)C)C

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isomeric SMILES

C=CC(C)(C)OC[C@@H]1NC(=O)[C@H]([C@@H](C)OC(C)(C)C=C)NC(=O)[C@@H]2CSC(=N2)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](C)NC(=O)[C@H]([C@@H](C)CC)NC1=O

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2 references

Patellins 1-6 and Trunkamide A: Novel Cyclic Hexa-, Hepta- and Octa-peptides From Colonial Ascidians, Lissoclinum sp.

A global assembly line for cyanobactins

Identifiers

InChI=1S/C43H63N7O8S/c1-11-25(4)33-38(54)44-26(5)41(56)50-21-17-20-32(50)37(53)45-29(22-28-18-15-14-16-19-28)40-47-31(24-59-40)36(52)49-34(27(6)58-43(9,10)13-3)39(55)46-30(35(51)48-33)23-57-42(7,8)12-2/h12-16,18-19,25-27,29-34H,2-3,11,17,20-24H2,1,4-10H3,(H,44,54)(H,45,53)(H,46,55)(H,48,51)(H,49,52)/t25-,26-,27+,29+,30-,31-,32-,33-,34-/m0/s1

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UTERRJKSLJLXTA-RZZCCKHXSA-N

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2 references

18 May 2023

based on heuristic

inferred from InChIKey

matched by identifier from

UTERRJKSLJLXTA-RZZCCKHXSA-N

UniChem compound ID

1 reference

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