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(22Alpha)-hydroxy-campest-4-en-3-one

MNXM3121 is deprecated and here replaced by MNXM1371527
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1371527 Image of MNXM1371527
referencechebi:175321
formulaC28H46O2
global charge0
mol weight414.674
InChIKeyFMFAICDKESPFNH-HSKWBYRYSA-N
InChIInChI=1S/C28H46O2/c1-17(2)18(3)15-26(30)19(4)23-9-10-24-22-8-7-20-16-21(29)11-13-27(20,5)25(22)12-14-28(23,24)6/h16-19,22-26,30H,7-15H2,1-6H3/t18-,19+,22?,23?,24?,25?,26+,27+,28-/m1/s1
SMILESCC(C)[C@H](C)C[C@H](O)[C@@H](C)C1CCC2C3CCC4=CC(=O)CC[C@]4(C)C3CC[C@@]21C
MNX internals
InChI (mnx)InChI=1/C28H46O2/c1-17(2)18(3)15-26(30)19(4)23-9-10-24-22-8-7-20-16-21(29)11-13-27(20,5)25(22)12-14-28(23,24)6/h16-19,22-26,30H,7-15H2,1-6H3/t18-,19+,22?,23?,24?,25?,26+,27+,28-/m1/s1 Image of MNXM1371527
SMILES (mnx)[CH3:1][CH:17]([CH3:2])[C@H:18]([CH3:3])[CH2:15][C@@H:26]([C@@H:19]([CH3:4])[CH:23]1[CH2:9][CH2:10][CH:24]2[CH:22]3[CH2:8][CH2:7][C:20]4=[CH:16][C:21](=[O:29])[CH2:11][CH2:13][C@:27]4([CH3:5])[CH:25]3[CH2:12][CH2:14][C@:28]12[CH3:6])[OH:30]
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

CHEBI:175321
chebi:175321
FMFAICDKESPFNH-HSKWBYRYSA-N 		(22Alpha)-hydroxy-campest-4-en-3-one
(10R,13S)-17-[(2S,3S,5R)-3-hydroxy-5,6-dimethylheptan-2-yl]-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one