[D-Asp3,(E)‐Dhb7]MC‐HtyW (CHEM120672)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-04-06 08:39:45 UTC | ||||||||
| Update Date | 2026-05-21 08:52:41 UTC | ||||||||
| Accession Number | CHEM120672 | ||||||||
| Identification | |||||||||
| Common Name | [D-Asp3,(E)‐Dhb7]MC‐HtyW | ||||||||
| Class | Small Molecule | ||||||||
| Description | Not Available | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type |
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| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C57H70N8O13 | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 1074.506 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | (5R,8S,11R,15S,18S,19S,22R,E)-15-((1H-indol-3-yl)methyl)-2-ethylidene-8-(4-hydroxyphenethyl)-18-((1E,3E,5S,6S)-6-methoxy-3,5-dimethyl-7-phenylhepta-1,3-dien-1-yl)-5,19-dimethyl-3,6,9,13,16,20,25-heptaoxo-1,4,7,10,14,17,21-heptaazacyclopentacosane-11,22-dicarboxylic acid | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | Not Available | ||||||||
| InChI Identifier | InChI=1S/C57H70N8O13/c1-7-41-53(71)59-35(5)52(70)63-44(24-20-36-18-21-39(66)22-19-36)54(72)65-47(57(76)77)30-50(68)61-46(29-38-31-58-43-16-12-11-15-40(38)43)55(73)62-42(34(4)51(69)64-45(56(74)75)25-26-49(67)60-41)23-17-32(2)27-33(3)48(78-6)28-37-13-9-8-10-14-37/h7-19,21-23,27,31,33-35,42,44-48,58,66H,20,24-26,28-30H2,1-6H3,(H,59,71)(H,60,67)(H,61,68)(H,62,73)(H,63,70)(H,64,69)(H,65,72)(H,74,75)(H,76,77)/b23-17+,32-27+,41-7+/t33-,34-,35+,42-,44-,45+,46-,47+,48-/m0/s1 | ||||||||
| InChI Key | AQBLNSUXUYUERE-KDEIUMRESA-N | ||||||||
| Chemical Taxonomy | |||||||||
| Classification | Not classified | ||||||||
| Biological Properties | |||||||||
| Status | Detected and Not Quantified | ||||||||
| Origin | Not Available | ||||||||
| Cellular Locations | Not Available | ||||||||
| Biofluid Locations | Not Available | ||||||||
| Tissue Locations | Not Available | ||||||||
| Pathways | Not Available | ||||||||
| Applications | Not Available | ||||||||
| Biological Roles | Not Available | ||||||||
| Chemical Roles | Not Available | ||||||||
| Physical Properties | |||||||||
| State | Not Available | ||||||||
| Appearance | Not Available | ||||||||
| Experimental Properties |
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| Predicted Properties | Not Available | ||||||||
| Spectra | |||||||||
| Spectra |
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| Toxicity Profile | |||||||||
| Route of Exposure | Not Available | ||||||||
| Mechanism of Toxicity | Not Available | ||||||||
| Metabolism | Not Available | ||||||||
| Toxicity Values | Not Available | ||||||||
| Lethal Dose | Not Available | ||||||||
| Carcinogenicity (IARC Classification) | Not Available | ||||||||
| Uses/Sources | Not Available | ||||||||
| Minimum Risk Level | Not Available | ||||||||
| Health Effects | Not Available | ||||||||
| Symptoms | Not Available | ||||||||
| Treatment | Not Available | ||||||||
| Concentrations | |||||||||
| Not Available | |||||||||
| External Links | |||||||||
| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
