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(3beta,4alpha,5alpha,24(28)Z)-4,14-Dimethylstigmasta-9(11),24(28)-dien-3-ol

PropertiesImage
MNX_IDMNXM115092 Image of MNXM115092
referencehmdb:HMDB0034190
formulaC31H52O
global charge0
mol weight440.756
InChIKeyZIZODWXWMZVEEM-AQHIEDMUSA-N
InChIInChI=1S/C31H52O/c1-9-23(20(2)3)11-10-21(4)24-14-18-31(8)27-13-12-25-22(5)28(32)16-17-29(25,6)26(27)15-19-30(24,31)7/h9,15,20-22,24-25,27-28,32H,10-14,16-19H2,1-8H3/b23-9-
SMILESC/C=C(/CCC(C)C1CCC2(C)C3CCC4C(C)C(O)CCC4(C)C3=CCC12C)C(C)C
MNX internals
InChI (mnx)InChI=1/C31H52O/c1-9-23(20(2)3)11-10-21(4)24-14-18-31(8)27-13-12-25-22(5)28(32)16-17-29(25,6)26(27)15-19-30(24,31)7/h9,15,20-22,24-25,27-28,32H,10-14,16-19H2,1-8H3/b23-9-/t21?,22?,24?,25?,27?,28?,29?,30?,31? Image of MNXM115092
SMILES (mnx)[CH3:1]/[CH:9]=[C:23](/[CH2:11][CH2:10][CH:21]([CH3:4])[CH:24]1[CH2:14][CH2:18][C:31]2([CH3:8])[CH:27]3[CH2:13][CH2:12][CH:25]4[CH:22]([CH3:5])[CH:28]([OH:32])[CH2:16][CH2:17][C:29]4([CH3:6])[C:26]3=[CH:15][CH2:19][C:30]12[CH3:7])[CH:20]([CH3:2])[CH3:3]
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
hmdb:HMDB0034190
ZIZODWXWMZVEEM-AQHIEDMUSA-N
(3beta,4alpha,5alpha,24(28)Z)-4,14-Dimethylstigmasta-9(11),24(28)-dien-3-ol
(3b,4a,5a,24(28)Z)-4,14-Dimethylstigmasta-9(11),24(28)-dien-3-ol
(3beta,4alpha,5alpha,24(28)Z)-4,14-dimethylstigmasta-9(11),24(28)-dien-3-ol
14-[(5Z)-5-isopropylhept-5-en-2-yl]-2,6,11,15-tetramethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-1(17)-en-5-ol
2,6,11,15-tetramethyl-14-[(5Z)-5-(propan-2-yl)hept-5-en-2-yl]tetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-1(17)-en-5-ol

hmdb:HMDB34190
secondary/obsolete/fantasy identifier