(Q104665459)

English

(E)-N-[(2E,6Z,8Z,11S)-11-[4-[(2S)-2-[(3S,4R)-4,8-dihydroxy-7-methyl-1-oxo-3,4-dihydroisochromen-3-yl]propyl]-1,3-oxazol-2-yl]dodeca-2,6,8-trienyl]-3-methoxy-N-methylbut-2-enamide

chemical compound

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instance of

type of chemical entity

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subclass of

N-[11-[4-[2-(4,8-dihydroxy-7-methyl-1-oxo-3,4-dihydroisochromen-3-yl)propyl]-1,3-oxazol-2-yl]dodeca-2,6,8-trienyl]-3-methoxy-N-methylbut-2-enamide

1 reference

1 reference

592.314851748 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₄H₄₄N₂O₇

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canonical SMILES

O=C1OC(C(O)C2=CC=C(C(O)=C12)C)C(C)CC=3N=C(OC3)C(C)CC=CC=CCCC=CCN(C(=O)C=C(OC)C)C

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isomeric SMILES

CO/C(C)=C/C(=O)N(C)C/C=C/CC/C=C\C=C/C[C@H](C)c1nc(C[C@H](C)[C@@H]2OC(=O)c3c(ccc(C)c3O)[C@H]2O)co1

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found in taxon

Chondromyces crocatus

1 reference

stated in

The Ajudazols A and B, Novel Isochromanones fromChondromyces crocatus (Myxobacteria): Isolation and Structure Elucidation

Identifiers

InChI

InChI=1S/C34H44N2O7/c1-22-16-17-27-29(30(22)38)34(40)43-32(31(27)39)24(3)19-26-21-42-33(35-26)23(2)15-13-11-9-7-8-10-12-14-18-36(5)28(37)20-25(4)41-6/h7,9,11-14,16-17,20-21,23-24,31-32,38-39H,8,10,15,18-19H2,1-6H3/b9-7-,13-11-,14-12+,25-20+/t23-,24-,31+,32-/m0/s1

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InChIKey

YIAOKSMOIJEDIZ-DSELDYFISA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

YIAOKSMOIJEDIZ-DSELDYFISA-N

(Q104665459)

(E)-N-[(2E,6Z,8Z,11S)-11-[4-[(2S)-2-[(3S,4R)-4,8-dihydroxy-7-methyl-1-oxo-3,4-dihydroisochromen-3-yl]propyl]-1,3-oxazol-2-yl]dodeca-2,6,8-trienyl]-3-methoxy-N-methylbut-2-enamide

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