Vatamine
AlkaPlorer ID: AK317418
Synonym: None
IUPAC Name: 3-methyl-5-(3-methyl-1,2,3a,4-tetrahydropyrrolo[2,3-b]indol-8b-yl)-8b-[3-methyl-8b-[3-methyl-8b-[3-methyl-8b-[3-methyl-5-(3-methyl-1,2,3a,4-tetrahydropyrrolo[2,3-b]indol-8b-yl)-1,2,3a,4-tetrahydropyrrolo[2,3-b]indol-8b-yl]-1,2,3a,4-tetrahydropyrrolo[2,3-b]indol-5-yl]-1,2,3a,4-tetrahydropyrrolo[2,3-b]indol-5-yl]-1,2,3a,4-tetrahydropyrrolo[2,3-b]indol-5-yl]-1,2,3a,4-tetrahydropyrrolo[2,3-b]indole
Structure
SMILES: CN1CCC2(C3=CC=CC4=C3NC3N(C)CCC43C3=CC=CC4=C3NC3N(C)CCC43C3=CC=CC4=C3NC3N(C)CCC43C3=CC=CC4=C3NC3N(C)CCC43C34CCN(C)C3NC3=C(C56CCN(C)C5NC5=CC=CC=C56)C=CC=C34)C3=CC=CC=C3NC12
InChI: InChI=1S/C77H86N14/c1-85-38-31-71(45-17-8-10-29-57(45)78-64(71)85)47-19-12-20-48-59(47)80-66-73(48,33-40-87(66)3)49-21-13-22-50-60(49)81-67-74(50,34-41-88(67)4)51-23-14-24-52-61(51)82-68-75(52,35-42-89(68)5)54-26-16-28-56-63(54)84-70-77(56,37-44-91(70)7)76-36-43-90(6)69(76)83-62-53(25-15-27-55(62)76)72-32-39-86(2)65(72)79-58-30-11-9-18-46(58)72/h8-30,64-70,78-84H,31-44H2,1-7H3
InChIKey: CCZCLFNHTJAMLO-UHFFFAOYSA-N
Reference
Biological Activities of Pyrrolidinoindoline Alkaloids from<i>Calycodendron milnei</i>
PubChem CID: 10351367
LOTUS: LTS0027949
COCONUT: CNP0185540.1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Psychotria milnei | Psychotria | Rubiaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 1207.6329999999991
TPSA？: 106.89
MolLogP？: 9.9026
Number of H-Donors: 7
Number of H-Acceptors: 14
RingCount: 21
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|