| Properties | Image |
|---|
| MNX_ID | MNXM1385458 |
 |
| reference | chebi:203373 |
| formula | C33H45N5O7 |
| global charge | 0 |
| mol weight | 623.751 |
| InChIKey | DZRYOWIZOWQPCR-JIGKBLADSA-N |
| InChI | InChI=1S/C33H45N5O7/c1-20(2)26-32(43)37-19-11-16-24(37)30(41)36-17-9-7-14-23(36)31(42)38-18-10-8-15-25(38)33(44)45-21(3)27(29(40)34-26)35-28(39)22-12-5-4-6-13-22/h4-6,12-13,20-21,23-27H,7-11,14-19H2,1-3H3,(H,34,40)(H,35,39)/t21-,23+,24+,25+,26+,27+/m1/s1 |
| SMILES | CC(C)[C@@H]1NC(=O)[C@@H](NC(=O)C2=CC=CC=C2)[C@@H](C)OC(=O)[C@@H]2CCCCN2C(=O)[C@@H]2CCCCN2C(=O)[C@@H]2CCCN2C1=O |
MNX internals
| InChI (mnx) | InChI=1/C33H45N5O7/c1-20(2)26-32(43)37-19-11-16-24(37)30(41)36-17-9-7-14-23(36)31(42)38-18-10-8-15-25(38)33(44)45-21(3)27(29(40)34-26)35-28(39)22-12-5-4-6-13-22/h4-6,12-13,20-21,23-27H,7-11,14-19H2,1-3H3,(H,34,40)(H,35,39)/t21-,23+,24+,25+,26+,27+/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH:20]([CH3:2])[C@H:26]1[C:32](=[O:43])[N:37]2[CH2:19][CH2:11][CH2:16][C@H:24]2[C:30](=[O:41])[N:36]2[CH2:17][CH2:9][CH2:7][CH2:14][C@H:23]2[C:31](=[O:42])[N:38]2[CH2:18][CH2:10][CH2:8][CH2:15][C@H:25]2[C:33](=[O:44])[O:45][C@H:21]([CH3:3])[C@H:27]([N:35]=[C:28]([C:22]2=[CH:12][CH:5]=[CH:4][CH:6]=[CH:13]2)[OH:39])[C:29]([OH:40])=[N:34]1 |
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