H-DL-Ser-DL-Pro-DL-Ser-DL-Asn-DL-Ser-DL-Lys-DL-Cys(1)-DL-Pro-DL-Asp-Gly-DL-Pro-DL-Asp-DL-Cys(1)-DL-Phe-DL-Val-Gly-DL-Leu-DL-Met-NH2
AlkaPlorer ID: AK343377
Synonym: None
IUPAC Name: 2-[15-[[6-amino-2-[[2-[[2-[[2-[[[1-(2-amino-3-hydroxypropanoyl)pyrrolidin-2-yl]-hydroxymethylidene]amino]-1,3-dihydroxypropylidene]amino]-1,4-dihydroxy-4-iminobutylidene]amino]-1,3-dihydroxypropylidene]amino]-1-hydroxyhexylidene]amino]-23-(carboxymethyl)-5,8,22,25-tetrahydroxy-20-[C-hydroxy-N-[1-hydroxy-1-[1-hydroxy-1-[2-hydroxy-2-[1-hydroxy-1-(1-hydroxy-1-imino-4-methylsulfanylbutan-2-yl)imino-4-methylpentan-2-yl]iminoethyl]imino-3-methylbutan-2-yl]imino-3-phenylpropan-2-yl]carbonimidoyl]-2,14-dioxo-17,18-dithia-1,4,7,13,21,24-hexazatricyclo[24.3.0.09,13]nonacosa-4,7,21,24-tetraen-6-yl]acetic acid
Structure
SMILES: CSCCC(N=C(O)C(CC(C)C)N=C(O)CN=C(O)C(N=C(O)C(CC1=CC=CC=C1)N=C(O)C1CSSCC(N=C(O)C(CCCCN)N=C(O)C(CO)N=C(O)C(CC(=N)O)N=C(O)C(CO)N=C(O)C2CCCN2C(=O)C(N)CO)C(=O)N2CCCC2C(O)=NC(CC(=O)O)C(O)=NCC(=O)N2CCCC2C(O)=NC(CC(=O)O)C(O)=N1)C(C)C)C(=N)O
InChI: InChI=1S/C77H119N21O26S3/c1-38(2)26-44(65(112)85-42(62(81)109)20-25-125-5)84-57(103)31-82-75(122)61(39(3)4)95-68(115)45(27-40-14-7-6-8-15-40)87-71(118)51-36-126-127-37-52(77(124)98-24-13-19-55(98)73(120)89-47(29-59(105)106)63(110)83-32-58(104)96-22-11-17-53(96)72(119)90-48(30-60(107)108)67(114)93-51)94-64(111)43(16-9-10-21-78)86-69(116)49(34-100)91-66(113)46(28-56(80)102)88-70(117)50(35-101)92-74(121)54-18-12-23-97(54)76(123)41(79)33-99/h6-8,14-15,38-39,41-55,61,99-101H,9-13,16-37,78-79H2,1-5H3,(H2,80,102)(H2,81,109)(H,82,122)(H,83,110)(H,84,103)(H,85,112)(H,86,116)(H,87,118)(H,88,117)(H,89,120)(H,90,119)(H,91,113)(H,92,121)(H,93,114)(H,94,111)(H,95,115)(H,105,106)(H,107,108)
InChIKey: BIVHHUZLTJIRQO-UHFFFAOYSA-N
Reference
Scyliorhinin I and II: two novel tachykinins from dogfish gut
PubChem CID: 146156475
LOTUS: LTS0104565
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Scyliorhinus canicula | Scyliorhinus | Scyliorhinidae | Carcharhiniformes | Chondrichthyes | Chordata | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 1851.121000000001
TPSA？: 792.6800000000005
MolLogP？: 3.709739999999988
Number of H-Donors: 25
Number of H-Acceptors: 29
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|