Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA031865
PROPERTIES
| NPAID | NPA031865 |
|---|---|
| CLUSTER ID | 9284 |
| NODE ID | 6227 |
| NAME | N-acetyl-S-(8-methoxy-4H-thiazolo[5,4-b]indol-2-yl)-L-cysteine |
| FORMULA | C15H15N3O4S2 |
| MOLECULAR WEIGHT (Da) | 365.4360 |
| ACCURATE MASS (Da) | 365.0504 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Colletotrichum |
| ORIGIN SPECIES | dematium and Colletotrichum higginsianum |
| InChIKey | CCYURQHTZWFINX-VIFPVBQESA-N |
| InChI | InChI=1S/C15H15N3O4S2/c1-7(19)16-9(14(20)21)6-23-15-18-12-11-8(17-13(12)24-15)4-3-5-10(11)22-2/h3-5,9,17H,6H2,1-2H3,(H,16,19)(H,20,21)/t9-/m0/s1 |
| SMILES | COC1=CC=CC2=C1C1=C(N2)SC(SC[C@H](NC(C)=O)C(=O)O)=N1 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Pedras, M Soledade C; Thapa, Chintamani Unveiling fungal detoxification pathways of the cruciferous phytoalexin rapalexin A: Sequential L-cysteine conjugation, acetylation and oxidative cyclization mediated by Colletotrichum spp. Phytochemistry 2020 169 112188. | ||
|---|---|---|---|
| DOI | 10.1016/j.phytochem.2019.112188 | PMID | 31683228 |
