Antibiotic TAN 420A; 18,21-Quinone, 15-demethoxy, 4,5-dihydro, 4S-hydroxy, O12-Me 

AlkaPlorer ID: AK288770

Synonym: 4,5-Dihydro-4S-hydroxyherbimycin B 

IUPAC Name: None

Structure

SMILES: COC1CC(O)C=C(C)C(=O)NC2=CC(=O)C=C(CC(C)CC(OC)C(O)C(C)C=C(C)C1OC(N)=O)C2=O

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InChI: InChI=1S/C28H40N2O9/c1-14-7-18-11-20(32)12-21(25(18)34)30-27(35)17(4)10-19(31)13-23(38-6)26(39-28(29)36)16(3)9-15(2)24(33)22(8-14)37-5/h9-12,14-15,19,22-24,26,31,33H,7-8,13H2,1-6H3,(H2,29,36)(H,30,35)

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InChIKey: ZVKSMPPFLSZEAP-UHFFFAOYSA-N

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Reference

CAS: 1802568-47-3

Source

Properties Information

Molecule Weight: 548.6330000000003

TPSA: 174.48

MolLogP: 1.6291

Number of H-Donors: 4

Number of H-Acceptors: 9

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information