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Psychotridine

AlkaPlorer ID: AK046198

Synonym: '', 'Psychotridine'

IUPAC Name: (3aS,8bS)-5-[(3aR,8bR)-5-[(3aS,8bS)-3-methyl-1,2,3a,4-tetrahydropyrrolo[2,3-b]indol-8b-yl]-3-methyl-1,2,3a,4-tetrahydropyrrolo[2,3-b]indol-8b-yl]-8b-[(3aS,8bS)-5-[(3aR,8bR)-3-methyl-1,2,3a,4-tetrahydropyrrolo[2,3-b]indol-8b-yl]-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(C3=C4N[C@H]5N(C)CC[C@@]5([C@@]56CCN(C)[C@@H]5NC5=C6C=CC=C5[C@]56CCN(C)[C@H]5NC5=C6C=CC=C5[C@@]56CCN(C)[C@@H]5NC5=CC=CC=C56)C4=CC=C3)C3=CC=CC=C3N[C@H]12

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InChI: InChI=1S/C55H62N10/c1-61-28-23-51(33-13-6-8-21-41(33)56-46(51)61)35-15-10-16-36-43(35)58-48-53(36,25-30-63(48)3)38-18-12-20-40-45(38)60-50-55(40,27-32-65(50)5)54-26-31-64(4)49(54)59-44-37(17-11-19-39(44)54)52-24-29-62(2)47(52)57-42-22-9-7-14-34(42)52/h6-22,46-50,56-60H,23-32H2,1-5H3/t46-,47+,48+,49-,50-,51-,52+,53+,54+,55+/m0/s1

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InChIKey: DVJSMVZSIBHXAO-YISLDOMDSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Psychotria milnei Psychotria Rubiaceae Gentianales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 863.1709999999998

TPSA？: 76.35000000000001

MolLogP？: 7.156200000000008

Number of H-Donors: 5

Number of H-Acceptors: 10

RingCount: 15

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information