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[(6Ar,9R,10S,10aR)-7,9-dimethyl-5-(2-methylbut-3-en-2-yl)-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinolin-10-yl] acetate

MNXM53988 is deprecated and here replaced by MNXM1100304
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1100304 Image of MNXM1100304
referencechebi:181937
formulaC23H30N2O2
global charge0
mol weight366.505
InChIKeyOSICWVVWEXKSBD-NDKINLCJSA-N
InChIInChI=1S/C23H30N2O2/c1-7-23(4,5)22-16-11-18-20(15-9-8-10-17(24-22)19(15)16)21(27-14(3)26)13(2)12-25(18)6/h7-10,13,18,20-21,24H,1,11-12H2,2-6H3/t13-,18-,20-,21+/m1/s1
SMILESC=CC(C)(C)C1=C2C[C@@H]3[C@@H](C4=C2C(=CC=C4)N1)[C@@H](OC(C)=O)[C@H](C)CN3C
MNX internals
InChI (mnx)InChI=1/C23H30N2O2/c1-7-23(4,5)22-16-11-18-20(15-9-8-10-17(24-22)19(15)16)21(27-14(3)26)13(2)12-25(18)6/h7-10,13,18,20-21,24H,1,11-12H2,2-6H3/t13-,18-,20-,21+/m1/s1 Image of MNXM1100304
SMILES (mnx)[CH2:1]=[CH:7][C:23]([CH3:4])([CH3:5])[C:22]1=[C:16]2[CH2:11][C@@H:18]3[C@@H:20]([C:15]4=[C:19]2[C:17](=[CH:10][CH:8]=[CH:9]4)[NH:24]1)[C@@H:21]([O:27][C:14]([CH3:3])=[O:26])[C@H:13]([CH3:2])[CH2:12][N:25]3[CH3:6]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:181937
chebi:181937
OSICWVVWEXKSBD-NDKINLCJSA-N 		[(6Ar,9R,10S,10aR)-7,9-dimethyl-5-(2-methylbut-3-en-2-yl)-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinolin-10-yl] acetate
[(6aR,9R,10S,10aR)-7,9-dimethyl-5-(2-methylbut-3-en-2-yl)-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-g]quinolin-10-yl] acetate

seed.compound:cpd31107
seedM:cpd31107
kegg.compound:C20438
keggC:C20438
OSICWVVWEXKSBD-NDKINLCJSA-N
OSICWVVWEXKSBD-NDKINLCJSA-O 		Fumigaclavine C

seed.compound:cpd23360
seedM:cpd23360
OSICWVVWEXKSBD-XINZZLORSA-O 		fumigaclavine C

keggC:M_C20438
seedM:M_cpd23360
seedM:M_cpd31107 		secondary/obsolete/fantasy identifier