(+)-chimonanthine

AlkaPlorer ID: AK402142

Synonym: None

IUPAC Name: (3aS,8bR)-8b-[(3aS,8bR)-3-methyl-1,2,3a,4-tetrahydropyrrolo[2,3-b]indol-8b-yl]-3-methyl-1,2,3a,4-tetrahydropyrrolo[2,3-b]indole

Structure

SMILES: CN1CC[C@]2([C@]34CCN(C)[C@@H]3NC3=CC=CC=C34)C3=CC=CC=C3N[C@@H]12

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InChI: InChI=1S/C22H26N4/c1-25-13-11-21(15-7-3-5-9-17(15)23-19(21)25)22-12-14-26(2)20(22)24-18-10-6-4-8-16(18)22/h3-10,19-20,23-24H,11-14H2,1-2H3/t19-,20-,21-,22-/m0/s1

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InChIKey: HOYXPMHLHJOGHD-CMOCDZPBSA-N

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Source

Properties Information

Molecule Weight: 346.47800000000007

TPSA: 30.54

MolLogP: 3.036600000000001

Number of H-Donors: 2

Number of H-Acceptors: 4

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information