Search MNXref
 Feedback

phomalevone C

PropertiesImage
MNX_IDMNXM107744 Image of MNXM107744
referencechebi:68299
formulaC30H24O10
global charge0
mol weight544.512
InChIKeyDRYAIORIKWDUCC-AHFZSLFQSA-N
InChIInChI=1S/C30H24O10/c1-11-9-15-21(27(37)23-13(31)5-7-17(33)29(23,3)39-15)25(35)19(11)20-12(2)10-16-22(26(20)36)28(38)24-14(32)6-8-18(34)30(24,4)40-16/h5-10,17,31-33,35-36H,1-4H3/t17-,29-,30-/m0/s1
SMILESCC1=C(C2=C(C)C=C3O[C@]4(C)C(=C(O)C=C[C@@H]4O)C(=O)C3=C2O)C(O)=C2C(=O)C3=C(O)C=CC(=O)[C@]3(C)OC2=C1
MNX internals
InChI (mnx)InChI=1/C30H24O10/c1-11-9-15-21(27(37)23-13(31)5-7-17(33)29(23,3)39-15)25(35)19(11)20-12(2)10-16-22(26(20)36)28(38)24-14(32)6-8-18(34)30(24,4)40-16/h5-10,17,31-33,35-36H,1-4H3/t17-,29-,30-/m0/s1 Image of MNXM107744
SMILES (mnx)[CH3:1][C:11]1=[C:19]([C:20]2=[C:12]([CH3:2])[CH:10]=[C:16]3[C:22](=[C:26]2[OH:36])[C:28](=[O:38])[C:24]2=[C:14]([OH:32])[CH:6]=[CH:8][C:18](=[O:34])[C@:30]2([CH3:4])[O:40]3)[C:25]([OH:35])=[C:21]2[C:15](=[CH:9]1)[O:39][C@@:29]1([CH3:3])[C@@H:17]([OH:33])[CH:7]=[CH:5][C:13]([OH:31])=[C:23]1[C:27]2=[O:37]
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:68299
chebi:68299
DRYAIORIKWDUCC-AHFZSLFQSA-N
phomalevone C
(5'S,10aR,10a'R)-1,1',5',8,8'-pentahydroxy-3,3',10a,10a'-tetramethyl-5',10a'-dihydro-9H,9'H-2,2'-bixanthene-5,9,9'(10aH)-trione