Corazonin
AlkaPlorer ID: AK538681
Synonym: None
IUPAC Name: N-[1-[[1-[[1-[[2-[[1-[[1-[(1,4-diamino-1,4-dioxobutan-2-yl)amino]-3-hydroxy-1-oxobutan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]-2-[[2-[[3-hydroxy-2-[(5-oxopyrrolidine-2-carbonyl)amino]butanoyl]amino]-3-phenylpropanoyl]amino]pentanediamide
Structure
SMILES: CC(O)C(N=C(O)C(CC1=CNC2=CC=CC=C12)N=C(O)CN=C(O)C(CCCNC(=N)N)N=C(O)C(CO)N=C(O)C(CC1=CC=C(O)C=C1)N=C(O)C(CCC(=N)O)N=C(O)C(CC1=CC=CC=C1)N=C(O)C(N=C(O)C1CCC(O)=N1)C(C)O)C(O)=NC(CC(=N)O)C(=N)O
InChI: InChI=1S/C62H84N18O18/c1-30(82)50(60(97)75-41(52(65)89)26-47(64)86)80-58(95)44(25-34-27-69-37-12-7-6-11-36(34)37)72-49(88)28-70-53(90)38(13-8-22-68-62(66)67)73-59(96)45(29-81)78-57(94)42(24-33-14-16-35(84)17-15-33)76-54(91)40(18-20-46(63)85)74-56(93)43(23-32-9-4-3-5-10-32)77-61(98)51(31(2)83)79-55(92)39-19-21-48(87)71-39/h3-7,9-12,14-17,27,30-31,38-45,50-51,69,81-84H,8,13,18-26,28-29H2,1-2H3,(H2,63,85)(H2,64,86)(H2,65,89)(H,70,90)(H,71,87)(H,72,88)(H,73,96)(H,74,93)(H,75,97)(H,76,91)(H,77,98)(H,78,94)(H,79,92)(H,80,95)(H4,66,67,68)
InChIKey: UOABGUNWRLWTJU-UHFFFAOYSA-N
Reference
Isolation and structure of corazonin, a cardioactive peptide from the American cockroach
PubChem CID: 25082621
CAS: 122929-08-2
LOTUS: LTS0019577
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Periplaneta americana | Periplaneta | Blattidae | Blattodea | Insecta | Arthropoda | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 1369.4620000000004
TPSA？: 649.3400000000004
MolLogP？: 4.695980000000016
Number of H-Donors: 25
Number of H-Acceptors: 19
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|