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(24E)-3alpha-Acetoxy-15alpha-hydroxy-23-oxo-7,9(11),24-lanostatrien-26-oic acid

PropertiesImage
MNX_IDMNXM114951 Image of MNXM114951
referencechebi:175939
formulaC32H46O6
global charge0
mol weight526.714
InChIKeySUTMBPWDBAUJCG-MNDPQUGUSA-N
InChIInChI=1S/C32H46O6/c1-18(15-21(34)16-19(2)28(36)37)24-17-26(35)32(8)23-9-10-25-29(4,5)27(38-20(3)33)12-13-30(25,6)22(23)11-14-31(24,32)7/h9,11,16,18,24-27,35H,10,12-15,17H2,1-8H3,(H,36,37)/b19-16-
SMILESCC(=O)OC1CCC2(C)C3=CCC4(C)C(C(C)CC(=O)/C=C(/C)C(=O)O)CC(O)C4(C)C3=CCC2C1(C)C
MNX internals
InChI (mnx)InChI=1/C32H46O6/c1-18(15-21(34)16-19(2)28(36)37)24-17-26(35)32(8)23-9-10-25-29(4,5)27(38-20(3)33)12-13-30(25,6)22(23)11-14-31(24,32)7/h9,11,16,18,24-27,35H,10,12-15,17H2,1-8H3,(H,36,37)/b19-16-/t18?,24?,25?,26?,27?,30?,31?,32? Image of MNXM114951
SMILES (mnx)[CH3:1][CH:18]([CH2:15][C:21](/[CH:16]=[C:19](/[CH3:2])[C:28](=[O:36])[OH:37])=[O:34])[CH:24]1[CH2:17][CH:26]([OH:35])[C:32]2([CH3:8])[C:23]3=[CH:9][CH2:10][CH:25]4[C:29]([CH3:4])([CH3:5])[CH:27]([O:38][C:20]([CH3:3])=[O:33])[CH2:12][CH2:13][C:30]4([CH3:6])[C:22]3=[CH:11][CH2:14][C:31]12[CH3:7]
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:175939
chebi:175939
SUTMBPWDBAUJCG-MNDPQUGUSA-N
(24E)-3alpha-Acetoxy-15alpha-hydroxy-23-oxo-7,9(11),24-lanostatrien-26-oic acid
(Z)-6-(3-acetyloxy-15-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-methyl-4-oxohept-2-enoic acid
hmdb:HMDB0035386
SUTMBPWDBAUJCG-MNDPQUGUSA-N
(24E)-3alpha-Acetoxy-15alpha-hydroxy-23-oxo-7,9(11),24-lanostatrien-26-oic acid
(24E)-3a-Acetoxy-15a-hydroxy-23-oxo-7,9(11),24-lanostatrien-26-Oate
(24E)-3a-Acetoxy-15a-hydroxy-23-oxo-7,9(11),24-lanostatrien-26-Oic acid
(24E)-3alpha-Acetoxy-15alpha-hydroxy-23-oxo-7,9(11),24-lanostatrien-26-Oate
(24E)-3alpha-acetoxy-15alpha-hydroxy-23-oxo-7,9(11),24-lanostatrien-26-Oate
(24E)-3alpha-acetoxy-15alpha-hydroxy-23-oxo-7,9(11),24-lanostatrien-26-Oic acid
(2Z)-6-[5-(Acetyloxy)-12-hydroxy-2,6,6,11,15-pentamethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadeca-1(17),9-dien-14-yl]-2-methyl-4-oxohept-2-enoate
(2Z)-6-[5-(acetyloxy)-12-hydroxy-2,6,6,11,15-pentamethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadeca-1(17),9-dien-14-yl]-2-methyl-4-oxohept-2-enoic acid
3a-Acetoxy-15a-hydroxy-23-oxo-7,9(11),24E-lanostatrien-26-Oic acid

hmdb:HMDB35386
secondary/obsolete/fantasy identifier