2,6-dichloro-5-hydroxy-8-methyl-1-[(2S,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromeno[2,3-b]pyrrol-4-one

AlkaPlorer ID: AK388849

Synonym: None

IUPAC Name: 2,6-dichloro-5-hydroxy-8-methyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromeno[2,3-b]pyrrol-4-one

Structure

SMILES: CC1=CC(Cl)=C(O)C2=C1OC1=C(C=C(Cl)N1C1OC(CO)C(O)C(O)C1O)C2=O

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InChI: InChI=1S/C18H17Cl2NO8/c1-5-2-7(19)12(24)10-11(23)6-3-9(20)21(17(6)29-16(5)10)18-15(27)14(26)13(25)8(4-22)28-18/h2-3,8,13-15,18,22,24-27H,4H2,1H3

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InChIKey: GJZWQCRFWFXIHE-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 446.23900000000015

TPSA: 145.52

MolLogP: 1.0409200000000003

Number of H-Donors: 5

Number of H-Acceptors: 9

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information