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alpha-Micropteroxanthin A

PropertiesImage
MNX_IDMNXM119005 Image of MNXM119005
referencelipidmapsM:LMPR01070608
formulaC27H40O2
global charge0
mol weight396.615
InChIKeyUKYBIQCVRBJWBE-XCGRFGPVSA-N
InChIInChI=1S/C27H40O2/c1-21(11-7-8-12-22(2)15-10-18-28)13-9-14-23(3)16-17-26-24(4)19-25(29)20-27(26,5)6/h7-9,11-14,16-17,19,25-26,28-29H,10,15,18,20H2,1-6H3/b8-7+,13-9+,17-16+,21-11+,22-12+,23-14+/t25-,26-/m1/s1
SMILESCC1=C[C@@H](O)CC(C)(C)[C@@H]1/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(\C)CCCO
MNX internals
InChI (mnx)InChI=1/C27H40O2/c1-21(11-7-8-12-22(2)15-10-18-28)13-9-14-23(3)16-17-26-24(4)19-25(29)20-27(26,5)6/h7-9,11-14,16-17,19,25-26,28-29H,10,15,18,20H2,1-6H3/b8-7+,13-9+,17-16+,21-11+,22-12+,23-14+/t25-,26-/m1/s1 Image of MNXM119005
SMILES (mnx)[CH3:1][C:21](=[CH:11]\[CH:7]=[CH:8]\[CH:12]=[C:22](/[CH3:2])[CH2:15][CH2:10][CH2:18][OH:28])/[CH:13]=[CH:9]/[CH:14]=[C:23]([CH3:3])/[CH:16]=[CH:17]/[C@@H:26]1[C:24]([CH3:4])=[CH:19][C@@H:25]([OH:29])[CH2:20][C:27]1([CH3:5])[CH3:6]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

lipidmaps:LMPR01070608
lipidmapsM:LMPR01070608
UKYBIQCVRBJWBE-XCGRFGPVSA-N 		alpha-Micropteroxanthin A
(3S,6S)-11',12'-Dihydro-10'-apo-epsilon,psi-caroten-3,10'-diol
hmdb:HMDB0038504
UKYBIQCVRBJWBE-GYVFJTMISA-N 		alpha-Micropteroxanthin B
(3R,6S)-11',12'-dihydro-10'-apo-epsilon,Psi-carotene-3,10'-diol
4-[(1E,3E,5E,7E,9E,11E)-15-hydroxy-3,7,12-trimethylpentadeca-1,3,5,7,9,11-hexaen-1-yl]-3,5,5-trimethylcyclohex-2-en-1-ol
a-Micropteroxanthin b
alpha-micropteroxanthin b

CHEBI:184177
chebi:184177
UKYBIQCVRBJWBE-GYVFJTMISA-N 		alpha-Micropteroxanthin B
4-[(1E,3E,5E,7E,9E,11E)-15-hydroxy-3,7,12-trimethylpentadeca-1,3,5,7,9,11-hexaenyl]-3,5,5-trimethylcyclohex-2-en-1-ol

hmdb:HMDB38504 		secondary/obsolete/fantasy identifier