| Properties | Image |
|---|
| MNX_ID | MNXM1197801 |
 |
| reference | envipathM:...2699aae2e122 |
| formula | C24H28N5O7 |
| global charge | -1 |
| mol weight | 498.516 |
| InChIKey | VWUDQXUNSUEEOM-UHFFFAOYSA-M |
| InChI | InChI=1S/C24H29N5O7/c1-4-5-6-18(32)29(24(36,13(2)3)23(34)35)12-14-7-9-15(10-8-14)19-16(30)11-17(31)21(33)20(19)22-25-27-28-26-22/h7-11,13,30-31,33,36H,4-6,12H2,1-3H3,(H,34,35)(H,25,26,27,28)/p-1 |
| SMILES | CCCCC(=O)N(CC1=CC=C(C2=C(O)C=C(O)C(O)=C2C2=NNN=N2)C=C1)C(O)(C(=O)[O-])C(C)C |
MNX internals
| InChI (mnx) | InChI=1/C24H29N5O7/c1-4-5-6-18(32)29(24(36,13(2)3)23(34)35)12-14-7-9-15(10-8-14)19-16(30)11-17(31)21(33)20(19)22-25-27-28-26-22/h7-11,13,30-31,33,36H,4-6,12H2,1-3H3,(H,34,35)(H,25,26,27,28)/t24? |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:5][CH2:6][C:18]([N:29]([CH2:12][C:14]1=[CH:8][CH:10]=[C:15]([C:19]2=[C:20]([C:22]3=[N:25][NH:27][N:28]=[N:26]3)[C:21]([OH:33])=[C:17]([OH:31])[CH:11]=[C:16]2[OH:30])[CH:9]=[CH:7]1)[C:24]([CH:13]([CH3:2])[CH3:3])([C:23](=[O:34])[OH:35])[OH:36])=[O:32] |
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