(Q105229848)

English

7,11-Dihydroxy-8,8,10,12,16-pentamethyl-3-[1-(2-methyl-1,3-thiazol-4-yl)prop-1-en-2-yl]-4,17-dioxabicyclo[14.1.0]heptadecane-5,9-dione

group of stereoisomers with the chemical formula C₂₇H₄₁NO₆S

In more languages

Statements

group of stereoisomers

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thiazole alkaloid

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thiazole alkaloid

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507.265459032 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₇H₄₁NO₆S

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canonical SMILES

O=C1OC(C(=CC=2N=C(SC2)C)C)CC3OC3(C)CCCC(C)C(O)C(C(=O)C(C)(C)C(O)C1)C

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Myxococcus xanthus

1 reference

A new cytotoxic epothilone from modified polyketide synthases heterologously expressed in Myxococcus xanthus

Sorangium cellulosum

2 references

Isolation and characterization of the epothilone biosynthetic gene cluster from Sorangium cellulosum

New natural epothilones from Sorangium cellulosum, strains So ce90/B2 and So ce90/D13: isolation, structure elucidation, and SAR studies

Identifiers

InChI=1S/C27H41NO6S/c1-15-9-8-10-27(7)22(34-27)12-20(16(2)11-19-14-35-18(4)28-19)33-23(30)13-21(29)26(5,6)25(32)17(3)24(15)31/h11,14-15,17,20-22,24,29,31H,8-10,12-13H2,1-7H3

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QXRSDHAAWVKZLJ-UHFFFAOYSA-N

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2 references

17 September 2022

based on heuristic

inferred from InChIKey

matched by identifier from

QXRSDHAAWVKZLJ-UHFFFAOYSA-N

UniChem compound ID

1 reference

DSSTox substance ID

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matched by identifier from

QXRSDHAAWVKZLJ-UHFFFAOYSA-N

Human Metabolome Database ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

QXRSDHAAWVKZLJ-UHFFFAOYSA-N

Probes And Drugs ID

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