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(3aS)-jadomycin A

PropertiesImageOccurences in reactions
MNX_IDMNXM1378223Image of MNXM1378223
#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
formulaC24H21NO6
charge0
mass419.433
referencemetacycM:CPD-12938
InChIKeyAVMSKCRHMKXYOO-UHFFFAOYSA-N
InChIInChI=1S/C24H21NO6/c1-4-11(3)19-24(30)31-23-13-8-10(2)9-15(27)16(13)18-20(25(19)23)22(29)17-12(21(18)28)6-5-7-14(17)26/h5-9,11,19,23,26-27H,4H2,1-3H3
SMILES[CH3:1][CH2:4][CH:11]([CH3:3])[CH:19]1[C:24](=[O:30])[O:31][CH:23]2[c:13]3[cH:8][c:10]([CH3:2])[cH:9][c:15]([OH:27])[c:16]3[C:18]3=[C:20]([C:22](=[O:29])[c:17]4[c:12]([cH:6][cH:5][cH:7][c:14]4[OH:26])[C:21]3=[O:28])[N:25]12
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Similar chemical compounds in external resources
IdentifierDescription
metacyc.compound:CPD-12938
metacycM:CPD-12938
(3aS)-jadomycin A
metacyc.compound:CPD-21699
metacycM:CPD-21699
(3aR)-jadomycin A
metacyc.compound:Jadomycin-A
metacycM:Jadomycin-A
jadomycin A