(Q103817002)

English

cyclo[DL-Phe-DL-xiIle-Unk]

group of stereoisomers with the chemical formula C₃₀H₃₁N₇O₃S₄

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instance of

group of stereoisomers

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1 reference

biogenic cyclopeptide

1 reference

inferred from

biogenic cyclopeptide

mass

665.1371218520002 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₀H₃₁N₇O₃S₄

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canonical SMILES

CCC(C)C1NC(=O)C(Cc2ccccc2)NC(=O)C2CSC(=N2)c2csc(n2)-c2csc(n2)-c2csc(n2)C(C)NC1=O

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Identifiers

InChI

InChI=1S/C30H31N7O3S4/c1-4-15(2)23-26(40)31-16(3)27-34-20(12-41-27)29-36-22(14-43-29)30-35-21(13-44-30)28-33-19(11-42-28)25(39)32-18(24(38)37-23)10-17-8-6-5-7-9-17/h5-9,12-16,18-19,23H,4,10-11H2,1-3H3,(H,31,40)(H,32,39)(H,37,38)

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InChIKey

BTQRWSUKDHTMKD-UHFFFAOYSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

BTQRWSUKDHTMKD-UHFFFAOYSA-N

1 reference

(Q103817002)

cyclo[DL-Phe-DL-xiIle-Unk]

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