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(20S,24E)-20,26-Dihydroxy-24-dammaren-3-one

PropertiesImage
MNX_IDMNXM114942 Image of MNXM114942
referencehmdb:HMDB0033256
formulaC30H50O3
global charge0
mol weight458.727
InChIKeyYYUILYGGEOINGF-UKWGHVSLSA-N
InChIInChI=1S/C30H50O3/c1-20(19-31)9-8-15-30(7,33)22-12-17-28(5)21(22)10-11-24-27(4)16-14-25(32)26(2,3)23(27)13-18-29(24,28)6/h9,21-24,31,33H,8,10-19H2,1-7H3/b20-9-
SMILESC/C(=C/CCC(C)(O)C1CCC2(C)C1CCC1C3(C)CCC(=O)C(C)(C)C3CCC12C)CO
MNX internals
InChI (mnx)InChI=1/C30H50O3/c1-20(19-31)9-8-15-30(7,33)22-12-17-28(5)21(22)10-11-24-27(4)16-14-25(32)26(2,3)23(27)13-18-29(24,28)6/h9,21-24,31,33H,8,10-19H2,1-7H3/b20-9-/t21?,22?,23?,24?,27?,28?,29?,30? Image of MNXM114942
SMILES (mnx)[CH3:1]/[C:20](=[CH:9]/[CH2:8][CH2:15][C:30]([CH3:7])([CH:22]1[CH2:12][CH2:17][C:28]2([CH3:5])[CH:21]1[CH2:10][CH2:11][CH:24]1[C:27]3([CH3:4])[CH2:16][CH2:14][C:25](=[O:32])[C:26]([CH3:2])([CH3:3])[CH:23]3[CH2:13][CH2:18][C:29]12[CH3:6])[OH:33])[CH2:19][OH:31]
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:HMDB0033256
YYUILYGGEOINGF-UKWGHVSLSA-N
(20S,24E)-20,26-Dihydroxy-24-dammaren-3-one
14-[(5Z)-2,7-dihydroxy-6-methylhept-5-en-2-yl]-2,6,6,10,11-pentamethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecan-5-one

hmdb:HMDB33256
secondary/obsolete/fantasy identifier