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notoamide S

MNXM147522 is deprecated and replaced by MNXM1100576
PropertiesImage
MNX_IDMNXM1100576 Image of MNXM1100576
referencechebi:145683
formulaC26H33N3O3
global charge0
mol weight435.568
InChIKeyZGWIWQJHQKPWGB-PMACEKPBSA-N
InChIInChI=1S/C26H33N3O3/c1-6-26(4,5)23-18(14-19-25(32)29-13-7-8-20(29)24(31)27-19)16-11-12-21(30)17(22(16)28-23)10-9-15(2)3/h6,9,11-12,19-20,28,30H,1,7-8,10,13-14H2,2-5H3,(H,27,31)/t19-,20-/m0/s1
SMILESC=CC(C)(C)C1=C(C[C@@H]2NC(=O)[C@@H]3CCCN3C2=O)C2=C(N1)C(CC=C(C)C)=C(O)C=C2
MNX internals
InChI (mnx)InChI=1/C26H33N3O3/c1-6-26(4,5)23-18(14-19-25(32)29-13-7-8-20(29)24(31)27-19)16-11-12-21(30)17(22(16)28-23)10-9-15(2)3/h6,9,11-12,19-20,28,30H,1,7-8,10,13-14H2,2-5H3,(H,27,31)/t19-,20-/m0/s1 Image of MNXM1100576
SMILES (mnx)[CH2:1]=[CH:6][C:26]([CH3:4])([CH3:5])[C:23]1=[C:18]([CH2:14][C@H:19]2[C:25](=[O:32])[N:29]3[CH2:13][CH2:7][CH2:8][C@H:20]3[C:24]([OH:31])=[N:27]2)[C:16]2=[C:22]([C:17]([CH2:10][CH:9]=[C:15]([CH3:2])[CH3:3])=[C:21]([OH:30])[CH:12]=[CH:11]2)[NH:28]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:145683
chebi:145683
ZGWIWQJHQKPWGB-PMACEKPBSA-N 		notoamide S
(3S,8aS)-3-{[6-hydroxy-2-(2-methylbut-3-en-2-yl)-7-(3-methylbut-2-en-1-yl)-1H-indol-3-yl]methyl}hexahydropyrrolo[1,2-a]pyrazine-1,4-dione

metacyc.compound:CPD-17357
metacycM:CPD-17357
seed.compound:cpd32950
seedM:cpd32950
ZGWIWQJHQKPWGB-PMACEKPBSA-N 		notoamide S

seedM:M_cpd32950 		secondary/obsolete/fantasy identifier