Anthcolorin B
AlkaPlorer ID: AK016336
Synonym: None
IUPAC Name: (3S)-3-[[(3S,4aS,6aS,8S,10aR,10bS)-3-(2-hydroxypropan-2-yl)-6a,10b-dimethyl-7-methylidene-1,2,3,4a,5,6,8,9,10,10a-decahydrobenzo[f]chromen-8-yl]methyl]-1-(2-methylbut-3-en-2-yl)-3H-indol-2-one
Structure
SMILES: C=CC(C)(C)N1C(=O)[C@@H](C[C@@H]2CC[C@H]3[C@]4(C)CC[C@@H](C(C)(C)O)O[C@H]4CC[C@]3(C)C2=C)C2=CC=CC=C21
InChI: InChI=1S/C33H47NO3/c1-9-30(3,4)34-25-13-11-10-12-23(25)24(29(34)35)20-22-14-15-26-32(7,21(22)2)18-17-28-33(26,8)19-16-27(37-28)31(5,6)36/h9-13,22,24,26-28,36H,1-2,14-20H2,3-8H3/t22-,24-,26+,27-,28-,32+,33-/m0/s1
InChIKey: QWTTYYHQARGNPV-GVFLWGQJSA-N
Reference
Anthcolorins A–F, novel cytotoxic metabolites from a sea urchin-derived Aspergillus versicolor
PubChem CID: 71713240
LOTUS: LTS0078075
{NPAtlas: NPA014579
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aspergillus versicolor | Aspergillus | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 505.7430000000003
TPSA？: 49.77000000000001
MolLogP？: 7.17880000000001
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|