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previtamin D3

MNXM7697 is deprecated and replaced by MNXM727723
PropertiesImageOccurences in reactions
MNX_IDMNXM727723Image of MNXM727723
#reac
in my sandbox 0
in MNXref (generic)9
in models (compartimentalized) 4
formulaC27H44O
charge0
mass384.33922
referencechebi:8403
InChIKeyYUGCAAVRZWBXEQ-WHTXLNIXSA-N
InChIInChI=1S/C27H44O/c1-19(2)8-6-9-21(4)25-15-16-26-22(10-7-17-27(25,26)5)12-13-23-18-24(28)14-11-20(23)3/h10,12-13,19,21,24-26,28H,6-9,11,14-18H2,1-5H3/b13-12-/t21-,24+,25-,26+,27-/m1/s1
SMILESCC1=C(/C=C\C2=CCC[C@@]3(C)[C@H]2CC[C@@H]3[C@H](C)CCCC(C)C)C[C@@H](O)CC1
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:8403
chebi:8403 		previtamin D3
(3S,6Z)-9,10-secocholesta-5(10),6,8-trien-3-ol
(3beta,6Z)-9,10-secocholesta-5(10),6,8-trien-3-ol
(6Z)-(3S)-9,10-seco-5(10),6,8-cholestatrien-3-ol
(6Z)-tacalciol
pre-vitamin D3
precholecalciferol
previtamin D(3)
seed.compound:cpd04847
seedM:cpd04847 		Previtamin D(3)
(6Z)-(3S)-9,10-seco-5(10), 6,8-cholestatrien-3-ol
Previtamin D3
pre-vitamin D3
previtamin D3
kegg.compound:C07711
keggC:C07711 		Previtamin D(3)
Previtamin D3
bigg.metabolite:pd3
biggM:pd3 		Previtamin D3
hmdb:HMDB0006500 Previtamin D3
(1S)-3-[(Z)-2-[(1R,7aR)-7a-methyl-1-[(2R)-6-methylheptan-2-yl]-1,2,3,3a,6,7-hexahydroinden-4-yl]ethenyl]-4-methylcyclohex-3-en-1-ol
(1S)-3-[(Z)-2-[(1R,7aR)-7a-methyl-1-[(2R)-6-methylheptan-2-yl]-2,3,3a,6,7,7a-hexahydro-1H-inden-4-yl]ethenyl]-4-methylcyclohex-3-en-1-ol
(3beta,6Z)-9,10-Secocholesta-5(10),6,8-trien-3-ol
(6Z)-(3S)-9,10-Seco-5(10),6,8-cholestatrien-3-ol
1,25-Dihydroxy-3-epi-19-nor-previtamin D3
14-Epi-19-nortachysterol
Precalciferol
Precholecalciferol
Previtamin D(3)
Previtamin D(3), (3alpha,6Z)-isomer
Previtamin D(3), (3beta,6E)-isomer
Previtamin d_3 / precholecalciferol / (6Z)-tacalciol
Tachysterol 3
Tachysterol(3)
metacyc.compound:CPD-10570
metacycM:CPD-10570 		pre-vitamin D3
(6Z)-(3S)-9,10-seco-5(10), 6,8-cholestatrien-3-ol
previtamin D3
lipidmaps:LMST03020222
lipidmapsM:LMST03020222 		previtamin D3 / precholecalciferol / (6Z)-tacalciol
(6Z)-(3S)-9,10-seco-5(10),6,8-cholestatrien-3-ol
hmdb:HMDB06500
biggM:M_pd3
keggC:M_C07711
seedM:M_cpd04847 		secondary/obsolete/fantasy identifier