[D-Asp3,Ser7]MC-RR (CHEM120564)
| Record Information | |||||||||
|---|---|---|---|---|---|---|---|---|---|
| Version | 1.0 | ||||||||
| Creation Date | 2026-04-06 08:32:27 UTC | ||||||||
| Update Date | 2026-05-21 08:42:48 UTC | ||||||||
| Accession Number | CHEM120564 | ||||||||
| Identification | |||||||||
| Common Name | [D-Asp3,Ser7]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 | C47H73N13O13 | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 1027.545 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | (2S,5R,8S,11R,15S,18S,19S,22R)-8,15-bis(3-guanidinopropyl)-2-(hydroxymethyl)-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/C47H73N13O13/c1-25(21-26(2)36(73-5)22-29-11-7-6-8-12-29)15-16-30-27(3)39(64)59-33(44(69)70)17-18-37(62)56-35(24-61)43(68)54-28(4)40(65)58-32(14-10-20-53-47(50)51)42(67)60-34(45(71)72)23-38(63)55-31(41(66)57-30)13-9-19-52-46(48)49/h6-8,11-12,15-16,21,26-28,30-36,61H,9-10,13-14,17-20,22-24H2,1-5H3,(H,54,68)(H,55,63)(H,56,62)(H,57,66)(H,58,65)(H,59,64)(H,60,67)(H,69,70)(H,71,72)(H4,48,49,52)(H4,50,51,53)/b16-15+,25-21+/t26-,27-,28+,30-,31-,32-,33+,34+,35-,36-/m0/s1 | ||||||||
| InChI Key | WSHYAOXMZXNUAQ-MPCPOGOHSA-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 | ||||||||
