9S-alkterlactone B

AlkaPlorer ID: AK010251

Synonym: None

IUPAC Name: None

Structure

SMILES: O=C(O[C@]1(C)C2=C(C=C3OC)C(C=C3OC)=CC=N2)C4=C1C=CC5=C4OCO5

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InChI: InChI=1S/C21H17NO6/c1-21(13-4-5-14-18(27-10-26-14)17(13)20(23)28-21)19-12-9-16(25-3)15(24-2)8-11(12)6-7-22-19/h4-9H,10H2,1-3H3/t21-/m0/s1

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InChIKey: IWRSBTOTVLWAQD-NRFANRHFSA-N

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Properties Information

Molecule Weight: 379.36800000000017

TPSA: 76.11000000000001

MolLogP: 3.414600000000002

Number of H-Donors: 0

Number of H-Acceptors: 7

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information