(Q105278615)

English

[(5R,6E,8E,10E,13S,14S,15R,16E)-15,22,24-trihydroxy-5-methoxy-14,16-dimethyl-3-oxo-2-azabicyclo[18.3.1]tetracosa-1(23),6,8,10,16,20(24),21-heptaen-13-yl] (2R)-2-(2-methylpropanoylamino)propanoate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

polyene macrolide

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mass

598.325416432 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₃H₄₆N₂O₈

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canonical SMILES

COC1C=CC=CC=CCC(OC(=O)C(C)NC(=O)C(C)C)C(C)C(O)C(C)=CCCc2cc(O)cc(c2O)NC(=O)C1

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isomeric SMILES

CO[C@H]1/C=C/C=C/C=C/C[C@H](OC(=O)[C@@H](C)NC(=O)C(C)C)[C@@H](C)[C@@H](O)/C(C)=C/CCc2cc(O)cc(c2O)NC(=O)C1

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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/C33H46N2O8/c1-20(2)32(40)34-23(5)33(41)43-28-16-11-9-7-8-10-15-26(42-6)19-29(37)35-27-18-25(36)17-24(31(27)39)14-12-13-21(3)30(38)22(28)4/h7-11,13,15,17-18,20,22-23,26,28,30,36,38-39H,12,14,16,19H2,1-6H3,(H,34,40)(H,35,37)/b8-7+,11-9+,15-10+,21-13+/t22-,23-,26+,28+,30+/m1/s1

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InChIKey

USZBZEBESAPYHG-PTAMWMRPSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

USZBZEBESAPYHG-PTAMWMRPSA-N

(Q105278615)

[(5R,6E,8E,10E,13S,14S,15R,16E)-15,22,24-trihydroxy-5-methoxy-14,16-dimethyl-3-oxo-2-azabicyclo[18.3.1]tetracosa-1(23),6,8,10,16,20(24),21-heptaen-13-yl] (2R)-2-(2-methylpropanoylamino)propanoate

Statements

Identifiers

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