Search MNXref
 Feedback

lespeflorin A3

PropertiesImage
MNX_IDMNXM106128 Image of MNXM106128
referencechebi:66560
formulaC30H34O4
global charge0
mol weight458.598
InChIKeySAZBMMMZQLNWMN-MHZLTWQESA-N
InChIInChI=1S/C30H34O4/c1-18(2)7-9-22-16-24-25(31)17-27(33-29(24)23(28(22)32)11-8-19(3)4)20-10-12-26-21(15-20)13-14-30(5,6)34-26/h7-8,10,12-16,27,32H,9,11,17H2,1-6H3/t27-/m0/s1
SMILESCC(C)=CCC1=CC2=C(O[C@H](C3=CC=C4OC(C)(C)C=CC4=C3)CC2=O)C(CC=C(C)C)=C1O
MNX internals
InChI (mnx)InChI=1/C30H34O4/c1-18(2)7-9-22-16-24-25(31)17-27(33-29(24)23(28(22)32)11-8-19(3)4)20-10-12-26-21(15-20)13-14-30(5,6)34-26/h7-8,10,12-16,27,32H,9,11,17H2,1-6H3/t27-/m0/s1 Image of MNXM106128
SMILES (mnx)[CH3:1][C:18]([CH3:2])=[CH:7][CH2:9][C:22]1=[CH:16][C:24]2=[C:29]([C:23]([CH2:11][CH:8]=[C:19]([CH3:3])[CH3:4])=[C:28]1[OH:32])[O:33][C@H:27]([C:20]1=[CH:15][C:21]3=[C:26]([CH:12]=[CH:10]1)[O:34][C:30]([CH3:5])([CH3:6])[CH:14]=[CH:13]3)[CH2:17][C:25]2=[O: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

CHEBI:66560
chebi:66560
SAZBMMMZQLNWMN-MHZLTWQESA-N
lespeflorin A3
(2S)-7-hydroxy-2',2'-dimethyl-6,8-bis(3-methylbut-2-en-1-yl)-2,3-dihydro-2'H,4H-2,6'-bichromen-4-one