(Q105322947)

English

[(1S,3R)-3-[(1Z,3Z,5R,7R,8R,9E)-8-(2-aminoethyl)-10-[(2S)-3-ethyl-6-oxo-2,3-dihydropyran-2-yl]-5,8-dihydroxy-7-phosphonooxydeca-1,3,9-trienyl]cyclohexyl] 7-methyloctanoate

group of stereoisomers with the chemical formula C₃₄H₅₆NO₁₀P

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

669.364183622 dalton

1 reference

based on heuristic

inferred from isomeric SMILES

chemical formula

C₃₄H₅₆NO₁₀P

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canonical SMILES

O=C1OC(C=CC(O)(CCN)C(OP(=O)(O)O)CC(O)C=CC=CC2CCCC(OC(=O)CCCCCC(C)C)C2)C(C=C1)CC

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isomeric SMILES

CCC1C=CC(=O)O[C@H]1/C=C/[C@](O)(CCN)[C@@H](C[C@@H](O)/C=C\C=C/[C@@H]1CCC[C@H](OC(=O)CCCCCC(C)C)C1)OP(=O)(O)O

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found in taxon

Streptomyces platensis

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stated in

Novel microbial metabolites of the phoslactomycins family induce production of colony-stimulating factors by bone marrow stromal cells. II. Isolation, physico-chemical properties and structure determination

stated in

Novel microbial metabolites of the phoslactomycins family induce production of colony-stimulating factors by bone marrow stromal cells. II. Isolation, physico-chemical properties and structure determination

stated in

Identification of phoslactomycin biosynthetic gene clusters from Streptomyces platensis SAM-0654 and characterization of PnR1 and PnR2 as positive transcriptional regulators.

Identifiers

InChI

InChI=1S/C34H56NO10P/c1-4-27-17-18-33(38)44-30(27)19-20-34(39,21-22-35)31(45-46(40,41)42)24-28(36)14-9-8-12-26-13-10-15-29(23-26)43-32(37)16-7-5-6-11-25(2)3/h8-9,12,14,17-20,25-31,36,39H,4-7,10-11,13,15-16,21-24,35H2,1-3H3,(H2,40,41,42)/b12-8-,14-9-,20-19+/t26-,27?,28+,29+,30+,31-,34+/m1/s1

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InChIKey

WZBZEINGTVLIIY-VGHZCNFRSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

WZBZEINGTVLIIY-VGHZCNFRSA-N

1 reference

(Q105322947)

[(1S,3R)-3-[(1Z,3Z,5R,7R,8R,9E)-8-(2-aminoethyl)-10-[(2S)-3-ethyl-6-oxo-2,3-dihydropyran-2-yl]-5,8-dihydroxy-7-phosphonooxydeca-1,3,9-trienyl]cyclohexyl] 7-methyloctanoate

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Identifiers

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