Sanguidimerine; (8RS,8'SR)-form 

AlkaPlorer ID: AK312893

Synonym: meso-form, Chelidimerine, Alkaloid CM1 

IUPAC Name: 1,3-bis(24-methyl-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.02,10.04,8.014,22.017,21]tetracosa-1(13),2,4(8),9,11,14(22),15,17(21)-octaen-23-yl)propan-2-one

Structure

SMILES: CN1C2=C3C=C4OCOC4=CC3=CC=C2C2=CC=C3OCOC3=C2C1CC(=O)CC1C2=C3OCOC3=CC=C2C2=C(C3=CC4=C(C=C3C=C2)OCO4)N1C

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InChI: InChI=1S/C43H32N2O9/c1-44-30(38-24(7-9-32-42(38)53-19-47-32)26-5-3-21-11-34-36(51-17-49-34)15-28(21)40(26)44)13-23(46)14-31-39-25(8-10-33-43(39)54-20-48-33)27-6-4-22-12-35-37(52-18-50-35)16-29(22)41(27)45(31)2/h3-12,15-16,30-31H,13-14,17-20H2,1-2H3

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InChIKey: NIQFOSSBJJDEES-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 720.7340000000002

TPSA: 97.39

MolLogP: 8.273100000000005

Number of H-Donors: 0

Number of H-Acceptors: 11

RingCount: 12

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information