(Q105224663)

English

cyclo[DL-Leu-DL-N(Me)Val-DL-OxiIle-DL-N(Me)Val-DL-Phe-DL-N(Me)Phe-DL-Pro-DL-xiIle-DL-Val]

group of stereoisomers with the chemical formula C₅₉H₉₀N₈O₁₀

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Statements

instance of

group of stereoisomers

0 references

subclass of

biogenic cyclopeptide

1 reference

inferred from

biogenic cyclopeptide

mass

1,070.67799108 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₅₉H₉₀N₈O₁₀

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canonical SMILES

CCC(C)C1NC(=O)C2CCCN2C(=O)C(Cc2ccccc2)N(C)C(=O)C(Cc2ccccc2)NC(=O)C(C(C)C)N(C)C(=O)C(C(C)CC)OC(=O)C(C(C)C)N(C)C(=O)C(CC(C)C)NC(=O)C(C(C)C)NC1=O

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found in taxon

Aureobasidium pullulans

1 reference

stated in

Structures of aureobasidins B to R

Identifiers

InChI

InChI=1S/C59H90N8O10/c1-16-38(11)47-53(70)62-46(35(5)6)52(69)60-42(31-34(3)4)56(73)66(15)49(37(9)10)59(76)77-50(39(12)17-2)58(75)65(14)48(36(7)8)54(71)61-43(32-40-25-20-18-21-26-40)55(72)64(13)45(33-41-27-22-19-23-28-41)57(74)67-30-24-29-44(67)51(68)63-47/h18-23,25-28,34-39,42-50H,16-17,24,29-33H2,1-15H3,(H,60,69)(H,61,71)(H,62,70)(H,63,68)

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InChIKey

QNUNLUGOYVFWOP-UHFFFAOYSA-N

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2 references

15 September 2022

matched by identifier from

InChIKey

QNUNLUGOYVFWOP-UHFFFAOYSA-N

1 reference

(Q105224663)

cyclo[DL-Leu-DL-N(Me)Val-DL-OxiIle-DL-N(Me)Val-DL-Phe-DL-N(Me)Phe-DL-Pro-DL-xiIle-DL-Val]

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Identifiers

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