[Mdha-GSH7]MC-RR (CHEM120654)
| Record Information | |||||||||
|---|---|---|---|---|---|---|---|---|---|
| Version | 1.0 | ||||||||
| Creation Date | 2026-04-06 08:38:38 UTC | ||||||||
| Update Date | 2026-05-21 08:49:48 UTC | ||||||||
| Accession Number | CHEM120654 | ||||||||
| Identification | |||||||||
| Common Name | [Mdha-GSH7]MC-RR | ||||||||
| Class | Small Molecule | ||||||||
| Description | Not Available | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type |
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| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C59H92N16O18S | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 1344.650 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | (5R,8S,11R,12S,15S,18S,19S,22R)-2-((((R)-2-((S)-4-amino-4-carboxybutanamido)-3-((carboxymethyl)amino)-3-oxopropyl)thio)methyl)-8,15-bis(3-guanidinopropyl)-18-((1E,3E,5S,6S)-6-methoxy-3,5-dimethyl-7-phenylhepta-1,3-dien-1-yl)-1,5,12,19-tetramethyl-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/C59H92N16O18S/c1-30(25-31(2)43(93-7)26-35-13-9-8-10-14-35)17-19-37-32(3)48(80)73-40(56(89)90)20-22-45(77)75(6)42(29-94-28-41(51(83)67-27-46(78)79)69-44(76)21-18-36(60)55(87)88)54(86)68-34(5)50(82)72-39(16-12-24-66-59(63)64)53(85)74-47(57(91)92)33(4)49(81)71-38(52(84)70-37)15-11-23-65-58(61)62/h8-10,13-14,17,19,25,31-34,36-43,47H,11-12,15-16,18,20-24,26-29,60H2,1-7H3,(H,67,83)(H,68,86)(H,69,76)(H,70,84)(H,71,81)(H,72,82)(H,73,80)(H,74,85)(H,78,79)(H,87,88)(H,89,90)(H,91,92)(H4,61,62,65)(H4,63,64,66)/b19-17+,30-25+/t31-,32-,33-,34+,36-,37-,38-,39-,40+,41-,42?,43-,47+/m0/s1 | ||||||||
| InChI Key | OWQLCSFYIFFJLC-YBCHMKSDSA-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 | ||||||||
