Mucronine A

AlkaPlorer ID: AK023341

Synonym: 'Mucronine A', ''

IUPAC Name: None

Structure

SMILES: CC[C@H](C)[C@@H]1N=C(O)[C@@H](N(C)C)CC2=CC(=CC=C2OC)/C=C\[NH+]=C(O)[C@H](CC2=CC=CC=C2)N=C1O

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InChI: InChI=1S/C29H38N4O4/c1-6-19(2)26-29(36)31-23(17-20-10-8-7-9-11-20)27(34)30-15-14-21-12-13-25(37-5)22(16-21)18-24(33(3)4)28(35)32-26/h7-16,19,23-24,26H,6,17-18H2,1-5H3,(H,30,34)(H,31,36)(H,32,35)/p+1/b15-14-/t19-,23-,24-,26-/m0/s1

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InChIKey: ZGVZGFFCCVLGFC-BTIMGDGLSA-O

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Reference

SuperNatural Ⅲ: SN0470021-07

NPASS: NPC56965

Properties Information

Molecule Weight: 507.6550000000002

TPSA: 111.85

MolLogP: 3.128300000000002

Number of H-Donors: 4

Number of H-Acceptors: 4

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information