Search MNXref
 Feedback

Maoesin D

PropertiesImage
MNX_IDMNXM106455 Image of MNXM106455
referencechebi:70366
formulaC24H30O8
global charge0
mol weight446.496
InChIKeyFUWZKRPAEKGTSW-MIWKWXCYSA-N
InChIInChI=1S/C24H30O8/c1-12-15-5-6-16-22-8-7-17(32-14(3)26)21(4,10-30-13(2)25)18(22)20(28)24(29,31-11-22)23(16,9-15)19(12)27/h5-6,15-18,20,28-29H,1,7-11H2,2-4H3/t15-,16+,17+,18-,20+,21-,22-,23+,24+/m1/s1
SMILESC=C1C(=O)[C@]23C[C@H]1C=C[C@H]2[C@]12CC[C@H](OC(C)=O)[C@@](C)(COC(C)=O)[C@H]1[C@H](O)[C@]3(O)OC2
MNX internals
InChI (mnx)InChI=1/C24H30O8/c1-12-15-5-6-16-22-8-7-17(32-14(3)26)21(4,10-30-13(2)25)18(22)20(28)24(29,31-11-22)23(16,9-15)19(12)27/h5-6,15-18,20,28-29H,1,7-11H2,2-4H3/t15-,16+,17+,18-,20+,21-,22-,23+,24+/m1/s1 Image of MNXM106455
SMILES (mnx)[CH2:1]=[C:12]1[C@@H:15]2[CH:5]=[CH:6][C@H:16]3[C@:22]45[CH2:8][CH2:7][C@H:17]([O:32][C:14]([CH3:3])=[O:26])[C@@:21]([CH3:4])([CH2:10][O:30][C:13]([CH3:2])=[O:25])[C@H:18]4[C@H:20]([OH:28])[C@@:24]([OH:29])([C@:23]3([CH2:9]2)[C:19]1=[O:27])[O:31][CH2:11]5
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:70366
chebi:70366
FUWZKRPAEKGTSW-MIWKWXCYSA-N 		Maoesin D
3beta,19-diacetoxy-6beta,7beta,11alpha-trihydroxy-7alpha,20-epoxy-ent-kaur-11,16-dien-15-one