PCIDB

KNApSAcK Metabolite C00025141

Metabolite

KNApSAcK Entry

id C00025141
Name 3alpha-Dihydrocadambine
CAS RN 54483-84-0
Standard InChI InChI=1S/C27H34N2O10/c1-36-25(35)15-11-37-26(39-27-24(34)23(33)22(32)19(10-30)38-27)20-14(15)8-17-21-13(6-7-29(17)9-18(20)31)12-4-2-3-5-16(12)28-21/h2-5,11,14,17-20,22-24,26-28,30-34H,6-10H2,1H3/t14-,17?,18-,19?,20+,22-,23?,24+,26+,27+/m1/s1
Standard InChI (Main Layer) InChI=1S/C27H34N2O10/c1-36-25(35)15-11-37-26(39-27-24(34)23(33)22(32)19(10-30)38-27)20-14(15)8-17-21-13(6-7-29(17)9-18(20)31)12-4-2-3-5-16(12)28-21/h2-5,11,14,17-20,22-24,26-28,30-34H,6-10H2,1H3

Cluster

Phytochemical cluster No. 4
KCF-S cluster No. 618

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN C047702