(Q76386777)

English

[(5R,6E,8E,10E,13S,14S,15R,16E)-15-hydroxy-5-methoxy-14,16-dimethyl-3,22,24-trioxo-2-azabicyclo[18.3.1]tetracosa-1(23),6,8,10,16,20-hexaen-13-yl] (2R)-2-(cyclohexanecarbonylamino)propanoate

chemical compound

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subclass of

N-[(2S)-1-{[(6Z,8E,10E,14S,15S,16E)-3,15-dihydroxy-5-methoxy-14,16-dimethyl-22,24-dioxo-2-azabicyclo[18.3.1]tetracosa-1(23),2,6,8,10,16,20-heptaen-13-yl]oxy}-1-oxopropan-2-yl]cyclohexanecarboximidic acid

1 reference

1 reference

636.341066496 dalton

1 reference

1 reference

C₃₆H₄₈N₂O₈

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canonical SMILES

COC1C=CC=CC=CCC(OC(=O)C(C)NC(=O)C2CCCCC2)C(C)C(O)C(C)=CCCC2=CC(=O)C=C(NC(=O)C1)C2=O

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isomeric SMILES

C[C@@H]1[C@H](C/C=C/C=C/C=C/[C@@H](CC(=O)NC2=CC(=O)C=C(C2=O)CC/C=C(/[C@@H]1O)\C)OC)OC(=O)[C@@H](C)NC(=O)C3CCCCC3

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found in taxon

Streptomyces seoulensis

1 reference

stated in

New ansamycin analogues from the mutant strain of Streptomyces seoulensis

Identifiers

InChI

InChI=1S/C36H48N2O8/c1-23-14-13-17-27-20-28(39)21-30(34(27)42)38-32(40)22-29(45-4)18-11-6-5-7-12-19-31(24(2)33(23)41)46-36(44)25(3)37-35(43)26-15-9-8-10-16-26/h5-7,11-12,14,18,20-21,24-26,29,31,33,41H,8-10,13,15-17,19,22H2,1-4H3,(H,37,43)(H,38,40)/b6-5+,12-7+,18-11+,23-14+/t24-,25-,29+,31+,33+/m1/s1

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InChIKey

WWUVMHRJRCRFSL-NXBJUTJHSA-N

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PubChem CID

6440887

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matched by identifier from

InChIKey

WWUVMHRJRCRFSL-NXBJUTJHSA-N

1 reference

0 references

(Q76386777)

[(5R,6E,8E,10E,13S,14S,15R,16E)-15-hydroxy-5-methoxy-14,16-dimethyl-3,22,24-trioxo-2-azabicyclo[18.3.1]tetracosa-1(23),6,8,10,16,20-hexaen-13-yl] (2R)-2-(cyclohexanecarbonylamino)propanoate

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