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(22R,23R)-22,23-dihydroxycampesterol

MNXM6508 is deprecated and here replaced by MNXM1371988
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1371988 Image of MNXM1371988
referencechebi:80401
formulaC28H48O3
global charge0
mol weight432.689
InChIKeyUJGZOSZMMQGHPD-GTYSVAQVSA-N
InChIInChI=1S/C28H48O3/c1-16(2)17(3)25(30)26(31)18(4)22-9-10-23-21-8-7-19-15-20(29)11-13-27(19,5)24(21)12-14-28(22,23)6/h7,16-18,20-26,29-31H,8-15H2,1-6H3/t17-,18-,20-,21-,22+,23-,24-,25+,26+,27-,28+/m0/s1
SMILESCC(C)[C@H](C)[C@@H](O)[C@H](O)[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
MNX internals
InChI (mnx)InChI=1/C28H48O3/c1-16(2)17(3)25(30)26(31)18(4)22-9-10-23-21-8-7-19-15-20(29)11-13-27(19,5)24(21)12-14-28(22,23)6/h7,16-18,20-26,29-31H,8-15H2,1-6H3/t17-,18-,20-,21-,22+,23-,24-,25+,26+,27-,28+/m0/s1 Image of MNXM1371988
SMILES (mnx)[CH3:1][CH:16]([CH3:2])[C@H:17]([CH3:3])[C@H:25]([C@@H:26]([C@@H:18]([CH3:4])[C@H:22]1[CH2:9][CH2:10][C@H:23]2[C@@H:21]3[CH2:8][CH:7]=[C:19]4[CH2:15][C@@H:20]([OH:29])[CH2:11][CH2:13][C@:27]4([CH3:5])[C@H:24]3[CH2:12][CH2:14][C@:28]12[CH3:6])[OH:31])[OH:30]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)9
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:80401
chebi:80401
UJGZOSZMMQGHPD-GTYSVAQVSA-N 		(22R,23R)-22,23-dihydroxycampesterol
(22R,23R,24S)-ergost-5-ene-3beta,22,23-triol
campest-5-en-3beta,22R,23R-triol

seed.compound:cpd14968
seedM:cpd14968
UJGZOSZMMQGHPD-GTYSVAQVSA-N 		(22R,23R)-22,23-Dihydroxycampesterol
(22R,23R)-22,23-dihydroxycampesterol

metacyc.compound:CPD-12495
metacycM:CPD-12495
UJGZOSZMMQGHPD-GTYSVAQVSA-N 		(22R,23R)-22,23-dihydroxycampesterol
22,23-diOHCR

lipidmaps:LMST01031125
lipidmapsM:LMST01031125
UJGZOSZMMQGHPD-GTYSVAQVSA-N 		22,23-dihydroxycampesterol
Campest-5-en-3beta,22R,23R-triol
O3
ST 28:1

seedM:M_cpd14968 		secondary/obsolete/fantasy identifier