Thiocoraline
AlkaPlorer ID: AK315992
Synonym: PM 93135, Antibiotic PM 93135
IUPAC Name: 3-hydroxy-N-[20-[(3-hydroxyquinoline-2-carbonyl)amino]-2,12,15,25-tetramethyl-11,24-bis(methylsulfanylmethyl)-3,6,10,13,16,19,23,26-octaoxo-9,22,28,29-tetrathia-2,5,12,15,18,25-hexazabicyclo[12.12.4]triacontan-7-yl]quinoline-2-carboxamide
Structure
SMILES: CSCC1C(=O)SCC(NC(=O)C2=NC3=CC=CC=C3C=C2O)C(O)=NCC(=O)N(C)C2CSSCC(C(=O)N1C)N(C)C(=O)CN=C(O)C(NC(=O)C1=NC3=CC=CC=C3C=C1O)CSC(=O)C(CSC)N(C)C2=O
InChI: InChI=1S/C48H56N10O12S6/c1-55-31-23-75-76-24-32(46(68)58(4)34(22-72-6)48(70)74-19-29(41(63)49-17-37(55)61)53-43(65)39-35(59)15-25-11-7-9-13-27(25)51-39)56(2)38(62)18-50-42(64)30(20-73-47(69)33(21-71-5)57(3)45(31)67)54-44(66)40-36(60)16-26-12-8-10-14-28(26)52-40/h7-16,29-34,59-60H,17-24H2,1-6H3,(H,49,63)(H,50,64)(H,53,65)(H,54,66)
InChIKey: UPGGKUQISSWRJJ-UHFFFAOYSA-N
Reference
Genome rearrangements of Streptomyces albus J1074 lead to the carotenoid gene cluster activation
PubChem CID: 485475
CAS: 173046-02-1
LOTUS: LTS0227338
COCONUT: CNP0106623.5
{NPAtlas: NPA019774
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Julia | Juliidae | None | Gastropoda | Mollusca | Metazoa | Eukaryota |
| Micromonospora marina | Micromonospora | Micromonosporaceae | Micromonosporales | Actinomycetes | Actinomycetota | None | Bacteria |
| Verrucosispora sp. | Micromonospora | Micromonosporaceae | Micromonosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 1157.4359999999997
TPSA？: 305.0
MolLogP？: 2.9664000000000046
Number of H-Donors: 6
Number of H-Acceptors: 20
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|