KNApSAcK Metabolite C00023165
Metabolite
KNApSAcK Entry
| id | C00023165 |
|---|---|
| Name | Crassostreaxanthin B |
| CAS RN | 144601-87-6 |
| Standard InChI | InChI=1S/C40H54O4/c1-28(17-13-18-30(3)21-22-38-34(7)24-37(43)27-40(38,9)10)15-11-12-16-29(2)19-14-20-31(4)39(44)25-33(6)32(5)23-36(42)26-35(8)41/h11-20,36-37,42-43H,23-27H2,1-10H3/b12-11+,17-13+,19-14+,28-15+,29-16+,30-18+,31-20+,33-32+/t36?,37-/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C40H54O4/c1-28(17-13-18-30(3)21-22-38-34(7)24-37(43)27-40(38,9)10)15-11-12-16-29(2)19-14-20-31(4)39(44)25-33(6)32(5)23-36(42)26-35(8)41/h11-20,36-37,42-43H,23-27H2,1-10H3 |
Cluster
| Phytochemical cluster | No. 59 |
|---|---|
| KCF-S cluster | No. 262 |
Link
ChEMBL
| By standard InChI | |
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| By standard InChI Main Layer |
KEGG
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CTD
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