Verticillin D
AlkaPlorer ID: AK024272
Synonym: '(+)-Verticillin D', 'Verticillin D'
IUPAC Name: (1S,2S,3S,11R,14S)-2-hydroxy-14-[(1S)-1-hydroxyethyl]-3-[(1S,2S,3S,11R,14S)-2-hydroxy-14-[(1S)-1-hydroxyethyl]-18-methyl-13,17-dioxo-15,16-dithia-10,12,18-triazapentacyclo[12.2.2.01,12.03,11.04,9]octadeca-4,6,8-trien-3-yl]-18-methyl-15,16-dithia-10,12,18-triazapentacyclo[12.2.2.01,12.03,11.04,9]octadeca-4,6,8-triene-13,17-dione
Structure
SMILES: C[C@H](O)[C@@]12SS[C@]3(C(=O)N1C)[C@@H](O)[C@]1([C@@]45C6=CC=CC=C6N[C@@H]4N4C(=O)[C@]6([C@H](C)O)SS[C@]4(C(=O)N6C)[C@H]5O)C4=CC=CC=C4N[C@@H]1N3C2=O
InChI: InChI=1S/C32H32N6O8S4/c1-13(39)29-25(45)37-21-27(15-9-5-7-11-17(15)33-21,19(41)31(37,49-47-29)23(43)35(29)3)28-16-10-6-8-12-18(16)34-22(28)38-26(46)30(14(2)40)36(4)24(44)32(38,20(28)42)50-48-30/h5-14,19-22,33-34,39-42H,1-4H3/t13-,14-,19-,20-,21+,22+,27+,28+,29-,30-,31-,32-/m0/s1
InChIKey: SYHNGIDZSPMVHV-CWYANQADSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Clonostachys rosea | Clonostachys | Bionectriaceae | Hypocreales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 756.9100000000001
TPSA？: 186.22
MolLogP？: 0.0525999999999995
Number of H-Donors: 6
Number of H-Acceptors: 14
RingCount: 12
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|