(2R,3S,7S,14S)-2,3,5,20,23,27-hexahydroxy-4-methyl-15-azaheptacyclo[14.12.0.0²,⁷.0³,¹⁴.0⁸,¹³.0¹⁷,²⁶.0¹⁹,²⁴]octacosa-1(28),4,8(13),9,11,16,19(24),20,22,26-decaene-6,18,25-trione

AlkaPlorer ID: AK359591

Synonym: None

IUPAC Name: 2,3,5,20,23,27-hexahydroxy-4-methyl-15-azaheptacyclo[14.12.0.02,7.03,14.08,13.017,26.019,24]octacosa-1(28),4,8,10,12,16,19,21,23,26-decaene-6,18,25-trione

Structure

SMILES: CC1=C(O)C(=O)C2C3=CC=CC=C3C3NC4=C(C=C(O)C5=C4C(=O)C4=C(O)C=CC(O)=C4C5=O)C2(O)C13O

copy

InChI: InChI=1S/C28H19NO9/c1-9-22(33)25(36)20-10-4-2-3-5-11(10)26-27(9,37)28(20,38)12-8-15(32)18-19(21(12)29-26)24(35)17-14(31)7-6-13(30)16(17)23(18)34/h2-8,20,26,29-33,37-38H,1H3

copy

InChIKey: CUJOMOBZUHNQJD-UHFFFAOYSA-N

copy

Properties Information

Molecule Weight: 513.4580000000003

TPSA: 184.62

MolLogP: 2.176200000000002

Number of H-Donors: 7

Number of H-Acceptors: 10

RingCount: 7

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information