(3R,4S,6S,6aR,10R,12S,15S,15aS,15bS)-3-benzyl-6,12,15-trihydroxy-4,10,12-trimethyl-5-methylidene-2H,3H,4H,6H,6aH,9H,10H,11H,15H,15bH-cycloundeca[e]isoindol-1-one
AlkaPlorer ID: AK537188
Synonym: None
IUPAC Name: (1S,2R,5R,7S,9E,11R,12S,14S,15R,16S)-16-benzyl-2,5,12-trihydroxy-5,7,14-trimethyl-13-methylidene-17-azatricyclo[9.7.0.01,15]octadeca-3,9-dien-18-one
Structure
SMILES: C=C1[C@@H](C)[C@H]2[C@H](CC3=CC=CC=C3)N=C(O)[C@@]23[C@H](O)C=C[C@](C)(O)C[C@@H](C)C/C=C/[C@H]3[C@@H]1O
InChI: InChI=1S/C28H37NO4/c1-17-9-8-12-21-25(31)19(3)18(2)24-22(15-20-10-6-5-7-11-20)29-26(32)28(21,24)23(30)13-14-27(4,33)16-17/h5-8,10-14,17-18,21-25,30-31,33H,3,9,15-16H2,1-2,4H3,(H,29,32)/b12-8+,14-13?/t17-,18+,21-,22-,23+,24-,25+,27-,28-/m0/s1
InChIKey: UKQNIEMKORIOQM-MFEWMZDRSA-N
Reference
Three new 10-phenyl-(11)cytochalasans, cytochalasins N, O, and P from Phomopsis sp.
PubChem CID: 133612158
LOTUS: LTS0165112
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | None | Amphisphaeriaceae | Xylariales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 451.6070000000002
TPSA？: 93.28000000000002
MolLogP？: 4.007600000000004
Number of H-Donors: 4
Number of H-Acceptors: 4
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|