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neurosporaxanthin

PropertiesImage
MNX_IDMNXM4066 Image of MNXM4066
referencechebi:63069
formulaC35H45O2
global charge-1
mol weight497.743
InChIKeyUGJYMKZYSUMAKJ-ZGMBEONKSA-M
InChIInChI=1S/C35H46O2/c1-27(17-11-19-29(3)21-13-22-32(6)34(36)37)15-9-10-16-28(2)18-12-20-30(4)24-25-33-31(5)23-14-26-35(33,7)8/h9-13,15-22,24-25H,14,23,26H2,1-8H3,(H,36,37)/p-1/b10-9+,17-11+,18-12+,21-13+,25-24+,27-15+,28-16+,29-19+,30-20+,32-22+
SMILESCC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C=C(\C)C(=O)[O-])C(C)(C)CCC1
MNX internals
InChI (mnx)InChI=1/C35H46O2/c1-27(17-11-19-29(3)21-13-22-32(6)34(36)37)15-9-10-16-28(2)18-12-20-30(4)24-25-33-31(5)23-14-26-35(33,7)8/h9-13,15-22,24-25H,14,23,26H2,1-8H3,(H,36,37)/b10-9+,17-11+,18-12+,21-13+,25-24+,27-15+,28-16+,29-19+,30-20+,32-22+ Image of MNXM4066
SMILES (mnx)[CH3:1][C:27](=[CH:15]\[CH:9]=[CH:10]\[CH:16]=[C:28]([CH3:2])\[CH:18]=[CH:12]\[CH:20]=[C:30]([CH3:4])\[CH:24]=[CH:25]\[C:33]1=[C:31]([CH3:5])[CH2:23][CH2:14][CH2:26][C:35]1([CH3:7])[CH3:8])/[CH:17]=[CH:11]/[CH:19]=[C:29]([CH3:3])/[CH:21]=[CH:13]/[CH:22]=[C:32](\[CH3:6])[C:34](=[O:36])[OH:37]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:63069
chebi:63069
UGJYMKZYSUMAKJ-ZGMBEONKSA-M 		neurosporaxanthin
(2E,4E,6E,8E,10E,12E,14E,16E,18E,20E)-2,6,10,15,19-pentamethyl-21-(2,6,6-trimethylcyclohex-1-en-1-yl)henicosa-2,4,6,8,10,12,14,16,18,20-decaenoate
4'-apo-beta,psi-caroten-4'-oate
4'-apo-beta,psi-caroten-4'-oic acid anion
4'-apo-beta-caroten-4'-oate
4'-apo-beta-caroten-4'-oic acid anion
all-trans-2,6,10,15,19-pentamethyl-21-(2,6,6-trimethylcyclohex-1-en-1-yl)henicosa-2,4,6,8,10,12,14,16,18,20-decaenoate
all-trans-2,6,10,15,19-pentamethyl-21-(2,6,6-trimethylcyclohex-1-en-1-yl)henicosa-2,4,6,8,10,12,14,16,18,20-decaenoic acid anion
all-trans-neurosporaxanthin(1-)
beta-apo-4'-carotenoate
beta-apo-4'-carotenoic acid anion
neurosporaxanthin anion
neurosporaxanthin(1-)

lipidmaps:LMPR01070206
lipidmapsM:LMPR01070206
UGJYMKZYSUMAKJ-ZGMBEONKSA-N 		Neurosporaxanthin

kegg.compound:C08607
keggC:C08607
UGJYMKZYSUMAKJ-ZGMBEONKSA-N 		Neurosporaxanthin
all-trans-Neurosporaxanthin

seed.compound:cpd05514
seedM:cpd05514
UGJYMKZYSUMAKJ-ZGMBEONKSA-M 		Neurosporaxanthin
all-trans-Neurosporaxanthin
all-trans-neurosporaxanthin
beta-apo-4'-carotenoic acid
neurosporaxanthin

CHEBI:7540
chebi:7540
UGJYMKZYSUMAKJ-ZGMBEONKSA-N 		neurosporaxanthin
(2E,4E,6E,8E,10E,12E,14E,16E,18E,20E)-2,6,10,15,19-pentamethyl-21-(2,6,6-trimethylcyclohex-1-en-1-yl)henicosa-2,4,6,8,10,12,14,16,18,20-decaenoic acid
4'-apo-beta,psi-caroten-4'-oic acid
4'-apo-beta-caroten-4'-oic acid
all-trans-2,6,10,15,19-pentamethyl-21-(2,6,6-trimethylcyclohex-1-en-1-yl)henicosa-2,4,6,8,10,12,14,16,18,20-decaenoic acid
all-trans-neurosporaxanthin
beta-apo-4'-carotenoic acid

metacyc.compound:CPD-12930
metacycM:CPD-12930
UGJYMKZYSUMAKJ-ZGMBEONKSA-M 		neurosporaxanthin
all-trans-neurosporaxanthin
beta-apo-4'-carotenoic acid

keggC:M_C08607
seedM:M_cpd05514 		secondary/obsolete/fantasy identifier