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preandiloid B

PropertiesImage
MNX_IDMNXM1368239 Image of MNXM1368239
referenceseedM:cpd32388
formulaC25H32O5
global charge0
mol weight412.526
InChIKeyUTCYYFIBBKQVDQ-UVHKRSBMSA-N
InChIInChI=1S/C25H32O5/c1-13-19(27)18-14(12-29-21(18)28)24(5)11-16-23(4)9-8-17(26)22(2,3)15(23)7-10-25(16,6)30-20(13)24/h12,15-16,27H,7-11H2,1-6H3/t15-,16-,23-,24+,25-/m0/s1
SMILESCC1=C2O[C@@]3(C)CC[C@H]4C(C)(C)C(=O)CC[C@]4(C)[C@@H]3C[C@]2(C)C2=COC(=O)C2=C1O
MNX internals
InChI (mnx)InChI=1/C25H32O5/c1-13-19(27)18-14(12-29-21(18)28)24(5)11-16-23(4)9-8-17(26)22(2,3)15(23)7-10-25(16,6)30-20(13)24/h12,15-16,27H,7-11H2,1-6H3/t15-,16-,23-,24+,25-/m0/s1 Image of MNXM1368239
SMILES (mnx)[CH3:1][C:2]1=[C:3]2[CH2:4][C@:5]3([CH3:6])[CH2:7][CH2:8][C@H:9]4[C:10]([CH3:11])([CH3:12])[C:13](=[CH2:14])[CH2:15][CH2:16][C@@:17]4([CH3:18])[C@H:19]3[CH2:20][C@@:21]2([CH3:22])[C:23]2=[CH:24][CH2:25][O:26](=[O:27])[O:28]2=[O:29]1[OH:30]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

seed.compound:cpd32388
seedM:cpd32388
UTCYYFIBBKQVDQ-UVHKRSBMSA-N 		preandiloid B

seedM:M_cpd32388 		secondary/obsolete/fantasy identifier