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staurosporine

PropertiesImage
MNX_IDMNXM4828 Image of MNXM4828
referencechebi:57491
formulaC28H27N4O3
global charge1
mol weight467.549
InChIKeyHKSZLNNOFSGOKW-FYTWVXJKSA-O
InChIInChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/p+1/t17-,20-,26-,28+/m1/s1
SMILESC[NH2+][C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4
MNX internals
InChI (mnx)InChI=1/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20-,26-,28+/m1/s1 Image of MNXM4828
SMILES (mnx)[c:1]12[c:2]([c:4]3[c:3]4[c:5]5[c:6]1-[c:14]1[c:13]([cH:18][cH:17][cH:16][cH:15]1)[CH:19]5[N@@:31]1([NH2:32])[CH2:21][C@H:24]([CH:20]4[c:7]4[c:8]-3[cH:10][cH:9][cH:12][cH:11]4)[CH2:23][C@H:22]([CH2:25][CH3:26])[O:33]1[O:34][OH:35])[N:29](=[NH:30])[CH2:27][CH2:28]2
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:57491
chebi:57491
HKSZLNNOFSGOKW-FYTWVXJKSA-O 		staurosporine
(5S,6R,7R,9R)-6-methoxy-5-methyl-7-methylazaniumyl-6,7,8,9,15,16-hexahydro-5H,14H-5,9-epoxy-4b,9a,15-triazadibenzo[b,h]cyclonona[1,2,3,4-jkl]cyclopenta[e]-as-indacen-14-one
(5S,6R,7R,9R)-6-methoxy-N,5-dimethyl-14-oxo-6,7,8,9,15,16-hexahydro-5H,14H-5,9-epoxy-4b,9a,15-triazadibenzo[b,h]cyclonona[1,2,3,4-jkl]cyclopenta[e]-as-indacen-7-aminium
staurosporinium
staurosporinium cation

seed.compound:cpd01410
seedM:cpd01410
HKSZLNNOFSGOKW-FYTWVXJKSA-O 		Staurosporine
AM-2282
STP
STS
staurosporine

kegg.compound:C02079
keggC:C02079
HKSZLNNOFSGOKW-ZGQXJOJZSA-N 		Staurosporine
STS

CHEBI:15738
chebi:15738
HKSZLNNOFSGOKW-FYTWVXJKSA-N 		staurosporine
(+)-Staurosporine
(5S,6R,7R,9R)-6-methoxy-5-methyl-7-methylamino-6,7,8,9,15,16-hexahydro-5H,14H-5,9-epoxy-4b,9a,15-triazadibenzo[b,h]cyclonona[1,2,3,4-jkl]cyclopenta[e]-as-indacen-14-one
AM-2282
STS
Staurosporin
Staurosporine
antibiotic AM 2282

metacyc.compound:STAUROSPORINE
metacycM:STAUROSPORINE
HKSZLNNOFSGOKW-FYTWVXJKSA-O 		staurosporine
AM-2282
STP

chebi:15106
chebi:45788
chebi:9252
keggC:M_C02079
seedM:M_cpd01410 		secondary/obsolete/fantasy identifier