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epothilone D

PropertiesImageOccurences in reactions
MNX_IDMNXM1103568Image of MNXM1103568
#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
formulaC27H41NO5S
charge0
mass491.27054
referencechebi:29579
InChIKeyXOZIUKBZLSUILX-GIQCAXHBSA-N
InChIInChI=1S/C27H41NO5S/c1-16-9-8-10-17(2)25(31)19(4)26(32)27(6,7)23(29)14-24(30)33-22(12-11-16)18(3)13-21-15-34-20(5)28-21/h11,13,15,17,19,22-23,25,29,31H,8-10,12,14H2,1-7H3/b16-11-,18-13+/t17-,19+,22-,23-,25-/m0/s1
SMILESC/C1=C/C[C@@H](/C(C)=C/c2csc(C)n2)OC(=O)C[C@H](O)C(C)(C)C(=O)[C@H](C)[C@@H](O)[C@@H](C)CCC1
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:29579
chebi:29579
epothilone D
(-)-desoxyepothilone B
(-)-epothilone D
(4S,7R,8S,9S,13Z,16S)-4,8-dihydroxy-5,5,7,9,13-pentamethyl-16-[(1E)-1-(2-methyl-1,3-thiazol-4-yl)prop-1-en-2-yl]oxacyclohexadec-13-ene-2,6-dione
12,13-deoxyepothilone B
12,13-desoxyepothilone B
Epo D
KOS 862
KOS-862
NSC 703147
NSC-703147
seed.compound:cpd08830
seedM:cpd08830
kegg.compound:C12039
keggC:C12039
Epothilone D
Desoxyepothilone b
lipidmaps:LMPK04000001
lipidmapsM:LMPK04000001
epothilone D
chebi:42294
keggC:M_C12039
seedM:M_cpd08830
secondary/obsolete/fantasy identifier