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You are searching for "CFAMM00273663" in compound. Total 1 results found.
Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.
CFAM Mol ID | CFAMM00273663 |
Family | CFFID2681 Substance-P receptor Ligand [sar9,met(o2)11]-sp Family |
Superfamily | CFSID1924 Substance-P receptor and Vasopressin V2 receptor Binder Superfamily |
Class | CFCID1180 Class 2530 |
External ID | CHEMBL1651026 |
External Source | CHEMBL |
PubChem CID |
163829 |
Functional Category |
Bioactive |
Molecule Name |
Bhsar-SP |
IUPAC Name |
(2S)-2-[[(2S)-1-[(2S)-6-amino-2-[[(2S)-1-[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]pyrrolidine-2-carbonyl]amino]hexanoyl]pyrrolidine-2-carbonyl]amino]-N-[(2S)-5-amino-1-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-amino-4-methylsulfonyl-1-oxobutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]-methylamino]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1,5-dioxopentan-2-yl]pentanediamide |
Synonyms |
Substance P, sar(9) sulfone;(Sar(9))SP sulfone;9-Sar-substance P sulfone;Sarcosyl(9)-substance P sulfone;9-Sar-11-met(O2)-substance P;(Sar(9),met(O2)(11))SP;Substance P, sar(9)-met(O2)(11)-;9-Sarcosyl-11-methionine(O2)-substance P;Bolton hunter-9-sar-11-met(02)-substance P;Substance P, sarcosyl(9)-methionine(O2)(11)- |
InChi |
InChI=1S/C64H100N18O15S/c1-38(2)34-46(57(89)74-42(54(69)86)28-33-98(4,96)97)73-53(85)37-80(3)62(94)48(36-40-18-9-6-10-19-40)79-58(90)47(35-39-16-7-5-8-17-39)78-56(88)43(24-26-51(67)83)75-55(87)44(25-27-52(68)84)76-59(91)50-23-15-32-82(50)63(95)45(21-11-12-29-65)77-60(92)49-22-14-31-81(49)61(93)41(66)20-13-30-72-64(70)71/h5-10,16-19,38,41-50H,11-15,20-37,65-66H2,1-4H3,(H2,67,83)(H2,68,84)(H2,69,86)(H,73,85)(H,74,89)(H,75,87)(H,76,91)(H,77,92)(H,78,88)(H,79,90)(H4,70,71,72)/t41-,42-,43-,44-,45-,46-,47-,48-,49-,50-/m0/s1 |
InChiKey |
OUPXSLGGCPUZJJ-SARDKLJWSA-N |
Formula | C64H100N18O15S |
Molecular Weight | 1393.66 |
Cross Link | CHEMBL1651026 |
Structure |
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Statistics of CFAM Database |
CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes. |
How to cite our database |
C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering.
Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).
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Last update by |
2014.08.29
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Dr.
Chen Yuzong
Deputy
Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore
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