(5S,10R)-7,9-dibromo-N-(5-{[(5S,10R)-7,9-dibromo-10-hydroxy-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,6,8-trien-3-yl]formamido}-4-oxopentyl)-10-hydroxy-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,6,8-triene-3-carboxamide
AlkaPlorer ID: AK086915
Synonym: None
IUPAC Name: (5S,6R)-7,9-dibromo-N-[5-[[(5S,6R)-7,9-dibromo-6-hydroxy-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,7,9-triene-3-carbonyl]amino]-4-oxopentyl]-6-hydroxy-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,7,9-triene-3-carboxamide
Structure
SMILES: COC1=C(Br)[C@H](O)[C@@]2(C=C1Br)CC(C(=O)NCCCC(=O)CNC(=O)C1=NO[C@]3(C=C(Br)C(OC)=C(Br)[C@@H]3O)C1)=NO2
InChI: InChI=1S/C25H26Br4N4O9/c1-39-18-12(26)6-24(20(35)16(18)28)8-14(32-41-24)22(37)30-5-3-4-11(34)10-31-23(38)15-9-25(42-33-15)7-13(27)19(40-2)17(29)21(25)36/h6-7,20-21,35-36H,3-5,8-10H2,1-2H3,(H,30,37)(H,31,38)/t20-,21-,24+,25+/m0/s1
InChIKey: HTJRTHIVZLJNBR-KXTAGPOFSA-N
Source
Properties Information
Molecule Weight: 846.1180000000002
TPSA？: 177.36999999999998
MolLogP？: 2.4107000000000003
Number of H-Donors: 4
Number of H-Acceptors: 11
RingCount: 4
Activities Information
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