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beta-cryptoxanthin

MNXM1541 is deprecated and here replaced by MNXM729605
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM729605 Image of MNXM729605
referencechebi:10362
formulaC40H56O
global charge0
mol weight552.887
InChIKeyDMASLKHVQRHNES-FKKUPVFPSA-N
InChIInChI=1S/C40H56O/c1-30(18-13-20-32(3)23-25-37-34(5)22-15-27-39(37,7)8)16-11-12-17-31(2)19-14-21-33(4)24-26-38-35(6)28-36(41)29-40(38,9)10/h11-14,16-21,23-26,36,41H,15,22,27-29H2,1-10H3/b12-11+,18-13+,19-14+,25-23+,26-24+,30-16+,31-17+,32-20+,33-21+/t36-/m1/s1
SMILESCC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C2=C(C)C[C@@H](O)CC2(C)C)C(C)(C)CCC1
MNX internals
InChI (mnx)InChI=1/C40H56O/c1-30(18-13-20-32(3)23-25-37-34(5)22-15-27-39(37,7)8)16-11-12-17-31(2)19-14-21-33(4)24-26-38-35(6)28-36(41)29-40(38,9)10/h11-14,16-21,23-26,36,41H,15,22,27-29H2,1-10H3/b12-11+,18-13+,19-14+,25-23+,26-24+,30-16+,31-17+,32-20+,33-21+/t36-/m1/s1 Image of MNXM729605
SMILES (mnx)[CH3:1][C:30](=[CH:16]\[CH:11]=[CH:12]\[CH:17]=[C:31]([CH3:2])\[CH:19]=[CH:14]\[CH:21]=[C:33]([CH3:4])\[CH:24]=[CH:26]\[C:38]1=[C:35]([CH3:6])[CH2:28][C@@H:36]([OH:41])[CH2:29][C:40]1([CH3:9])[CH3:10])/[CH:18]=[CH:13]/[CH:20]=[C:32]([CH3:3])/[CH:23]=[CH:25]/[C:37]1=[C:34]([CH3:5])[CH2:22][CH2:15][CH2:27][C:39]1([CH3:7])[CH3:8]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)26
in models (compartimentalized) 3
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:10362
chebi:10362
DMASLKHVQRHNES-FKKUPVFPSA-N 		beta-cryptoxanthin
(3R)-beta,beta-caroten-3-ol
beta-Cryptoxanthin
cryptoxanthin

sabiork.compound:10683
sabiorkM:10683
kegg.compound:C08591
keggC:C08591
lipidmaps:LMPR01070269
lipidmapsM:LMPR01070269
DMASLKHVQRHNES-FKKUPVFPSA-N 		beta-Cryptoxanthin
hmdb:HMDB0033844
DMASLKHVQRHNES-FKKUPVFPSA-N 		beta-Cryptoxanthin
(1R)-3,5,5-trimethyl-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethylcyclohex-1-en-1-yl)octadeca-1,3,5,7,9,11,13,15,17-nonaen-1-yl]cyclohex-3-en-1-ol
(3R)-Cryptoxanthin
(3R)-beta,beta-Caroten-3-ol
(3R)-beta,beta-caroten-3-ol
(3R)-beta-Cryptoxanthin
(3R)-beta-cryptoxanthin
(R)-all-trans-beta-Caroten-3-ol
(R)-all-trans-beta-caroten-3-ol
3-Hydroxy-beta-carotene
Beta Caroten 3 ol
Beta Cryptoxanthin
Caricaxanthin
Cryptoxanthin
Cryptoxanthine
Cryptoxanthins
Cryptoxanthol
Kryptoxanthin
Neo-beta-cryptoxanthin
all-trans-Cryptoxanthin
all-trans-Cryptoxanthol
all-trans-Neocryptoxanthin
all-trans-Neocryptoxanthol
all-trans-beta-Cryptoxanthin
all-trans-beta-cryptoxanthin
b-Cryptoxanthin
beta-Caroten-3-ol
beta-caroten-3-ol
beta-cryptoxanthin
cryptoxanthin
trans-Cryptoxanthin
trans-beta-Crytoxanthin
trans-beta-crytoxanthin

seed.compound:cpd05498
seedM:cpd05498
DMASLKHVQRHNES-FKKUPVFPSA-N 		beta-Cryptoxanthin
beta,beta-carotene-3-ol
beta-cryptoxanthin

SLM:000501171
slm:000501171
DMASLKHVQRHNES-FKKUPVFPSA-N 		beta-cryptoxanthin

metacyc.compound:CPD-7409
metacycM:CPD-7409
DMASLKHVQRHNES-FKKUPVFPSA-N 		beta-cryptoxanthin
beta,beta-carotene-3-ol

hmdb:HMDB33844
keggC:M_C08591
seedM:M_cpd05498 		secondary/obsolete/fantasy identifier