PCIDB

KNApSAcK Metabolite C00041074

Metabolite

KNApSAcK Entry

id C00041074
Name N-Methyltaxol C / (-)-N-Methyltaxol C
CAS RN 153083-53-5
Standard InChI InChI=1S/C47H59NO14/c1-9-10-13-22-34(52)48(8)36(29-18-14-11-15-19-29)37(53)43(56)60-31-24-47(57)41(61-42(55)30-20-16-12-17-21-30)39-45(7,32(51)23-33-46(39,25-58-33)62-28(4)50)40(54)38(59-27(3)49)35(26(31)2)44(47,5)6/h11-12,14-21,31-33,36-39,41,51,53,57H,9-10,13,22-25H2,1-8H3/t31-,32-,33+,36-,37+,38+,39-,41-,45+,46?,47+/m0/s1
Standard InChI (Main Layer) InChI=1S/C47H59NO14/c1-9-10-13-22-34(52)48(8)36(29-18-14-11-15-19-29)37(53)43(56)60-31-24-47(57)41(61-42(55)30-20-16-12-17-21-30)39-45(7,32(51)23-33-46(39,25-58-33)62-28(4)50)40(54)38(59-27(3)49)35(26(31)2)44(47,5)6/h11-12,14-21,31-33,36-39,41,51,53,57H,9-10,13,22-25H2,1-8H3

Cluster

Phytochemical cluster No. 49
KCF-S cluster No. 238

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL290758

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
Spermatophyta 2

Family

family name count
Taxaceae 2

List (2)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Taxus baccata 25629 Taxaceae Spermatophyta Viridiplantae
Taxus media 85957 Taxaceae Spermatophyta Viridiplantae