(Q104246208)

English

Microginin FR9

group of stereoisomers with the chemical formula C₃₉H₅₄N₆O₉

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instance of

group of stereoisomers

0 references

1 reference

750.395227308 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₉H₅₄N₆O₉

0 references

canonical SMILES

CCCCCCCC(N)C(O)C(=O)NC(C(=O)N1CCCC1C(=O)NC(Cc1ccc(O)cc1)C(=O)NC(Cc1cc2ccccc2[nH]1)C(=O)O)C(C)O

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found in taxon

Microcystis

1 reference

stated in

Detection and identification of oligopeptides in Microcystis (cyanobacteria) colonies: toward an understanding of metabolic diversity

Identifiers

InChI

InChI=1S/C39H54N6O9/c1-3-4-5-6-7-12-28(40)34(48)37(51)44-33(23(2)46)38(52)45-19-10-14-32(45)36(50)42-30(20-24-15-17-27(47)18-16-24)35(49)43-31(39(53)54)22-26-21-25-11-8-9-13-29(25)41-26/h8-9,11,13,15-18,21,23,28,30-34,41,46-48H,3-7,10,12,14,19-20,22,40H2,1-2H3,(H,42,50)(H,43,49)(H,44,51)(H,53,54)

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InChIKey

MCMDDENRFTYQNV-UHFFFAOYSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

MCMDDENRFTYQNV-UHFFFAOYSA-N

ChEBI ID

214818

mapping relation type

exact match

1 reference

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C39H54N6O9/c1-3-4-5-6-7-12-28(40)34(48)37(51)44-33(23(2)46)38(52)45-19-10-14-32(45)36(50)42-30(20-24-15-17-27(47)18-16-24)35(49)43-31(39(53)54)22-26-21-25-11-8-9-13-29(25)41-26/h8-9,11,13,15-18,21,23,28,30-34,41,46-48H,3-7,10,12,14,19-20,22,40H2,1-2H3,(H,42,50)(H,43,49)(H,44,51)(H,53,54)

1 reference

1 reference

matched by identifier from

InChIKey

MCMDDENRFTYQNV-UHFFFAOYSA-N

Natural Product Atlas ID

NPA027644

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

MCMDDENRFTYQNV-UHFFFAOYSA-N

(Q104246208)

Microginin FR9

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