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fumitremorgin B

MNXM53994 is deprecated and here replaced by MNXM737933
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM737933 Image of MNXM737933
referencechebi:64531
formulaC27H33N3O5
global charge0
mol weight479.577
InChIKeyWEIYXEFMCIRZHC-MWGWWEMPSA-N
InChIInChI=1S/C27H33N3O5/c1-15(2)10-12-28-20-14-17(35-5)8-9-18(20)22-23(28)21(13-16(3)4)30-25(32)19-7-6-11-29(19)26(33)27(30,34)24(22)31/h8-10,13-14,19,21,24,31,34H,6-7,11-12H2,1-5H3/t19-,21-,24-,27+/m0/s1
SMILESCOC1=CC=C2C(=C1)N(CC=C(C)C)C1=C2[C@H](O)[C@@]2(O)C(=O)N3CCC[C@H]3C(=O)N2[C@H]1C=C(C)C
MNX internals
InChI (mnx)InChI=1/C27H33N3O5/c1-15(2)10-12-28-20-14-17(35-5)8-9-18(20)22-23(28)21(13-16(3)4)30-25(32)19-7-6-11-29(19)26(33)27(30,34)24(22)31/h8-10,13-14,19,21,24,31,34H,6-7,11-12H2,1-5H3/t19-,21-,24-,27+/m0/s1 Image of MNXM737933
SMILES (mnx)[CH3:1][C:15]([CH3:2])=[CH:10][CH2:12][N:28]1[C:20]2=[CH:14][C:17]([O:35][CH3:5])=[CH:8][CH:9]=[C:18]2[C:22]2=[C:23]1[C@H:21]([CH:13]=[C:16]([CH3:3])[CH3:4])[N:30]1[C:25](=[O:32])[C@@H:19]3[CH2:7][CH2:6][CH2:11][N:29]3[C:26](=[O:33])[C@:27]1([OH:34])[C@H:24]2[OH:31]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)6
in models (compartimentalized) 2
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:64531
chebi:64531
WEIYXEFMCIRZHC-MWGWWEMPSA-N 		fumitremorgin B
(5aR,6S,12S,14aS)-5a,6-dihydroxy-9-methoxy-11-(3-methylbut-2-en-1-yl)-12-(2-methylprop-1-en-1-yl)-1,2,3,5a,6,11,12,14a-octahydro-5H,14H-pyrrolo[1'',2'':4',5']pyrazino[1',2':1,6]pyrido[3,4-b]indole-5,14-dione
Lanosulin

kegg.compound:C20630
keggC:C20630
WEIYXEFMCIRZHC-MWGWWEMPSA-N 		Fumitremorgin B

seed.compound:cpd31241
seedM:cpd31241
WEIYXEFMCIRZHC-MWGWWEMPSA-N 		Fumitremorgin B
fumitremorgin B

metacyc.compound:CPD-15260
metacycM:CPD-15260
WEIYXEFMCIRZHC-MWGWWEMPSA-N 		fumitremorgin B
lanosulin

keggC:M_C20630
seedM:M_cpd31241 		secondary/obsolete/fantasy identifier