PCIDB

KNApSAcK Metabolite C00032660

Metabolite

KNApSAcK Entry

id C00032660
Name 5alpha,9alpha-Epidioxy-(22E)-ergosta-7,22-diene-3beta,6beta-diol / (-)-5alpha,9alpha-Epidioxy-(22E)-ergosta-7,22-diene-3beta,6beta-diol
CAS RN 348611-57-4
Standard InChI InChI=1S/C28H44O4/c1-17(2)18(3)7-8-19(4)21-9-10-22-23-15-24(30)28-16-20(29)11-12-26(28,6)27(23,31-32-28)14-13-25(21,22)5/h7-8,15,17-22,24,29-30H,9-14,16H2,1-6H3/b8-7+/t18-,19+,20-,21+,22-,24+,25+,26+,27+,28-/m0/s1
Standard InChI (Main Layer) InChI=1S/C28H44O4/c1-17(2)18(3)7-8-19(4)21-9-10-22-23-15-24(30)28-16-20(29)11-12-26(28,6)27(23,31-32-28)14-13-25(21,22)5/h7-8,15,17-22,24,29-30H,9-14,16H2,1-6H3

Cluster

Phytochemical cluster
KCF-S cluster No. 1685

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

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CTD

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