(Q104195170)

English

5-Amino-2-[27-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoctacosa-2,4,6,8,10,12,14,16,18,20,22,24-dodecaenoylamino]pentanoic acid

group of stereoisomers with the chemical formula C₃₉H₅₂N₂O₈

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

676.372366624 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₉H₅₂N₂O₈

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canonical SMILES

CC(CC=CC=CC=CC=CC=CC=CC=CC=CC=CC=CC=CC=CC(=O)NC(CCCN)C(=O)O)OC1OC(C)C(O)C(O)C1O

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found in taxon

Streptococcus agalactiae

1 reference

stated in

Granadaene: proposed structure of the group B Streptococcus polyenic pigment

Identifiers

InChI

InChI=1S/C39H52N2O8/c1-31(48-39-37(45)36(44)35(43)32(2)49-39)27-24-22-20-18-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19-21-23-25-29-34(42)41-33(38(46)47)28-26-30-40/h3-25,29,31-33,35-37,39,43-45H,26-28,30,40H2,1-2H3,(H,41,42)(H,46,47)

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InChIKey

PPFISAQUKQQDHW-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

PPFISAQUKQQDHW-UHFFFAOYSA-N

(Q104195170)

5-Amino-2-[27-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoctacosa-2,4,6,8,10,12,14,16,18,20,22,24-dodecaenoylamino]pentanoic acid

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