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You are searching for "CFAMM00303707" 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 | CFAMM00303707 |
Family | CFFID4178 Somatostatin receptor type 1 and Somatostatin receptor type 2 Ligand Cytotoxinpeptide Conjugate Family |
Superfamily | CFSAD806 ostatin receptor 5 Ligand Pasireotide Diaspartate Superfamily |
Class | CFCAD546 Class 546 |
External ID | CHEMBL407051 |
External Source | CHEMBL |
PubChem CID |
44388075 |
Functional Category |
Bioactive |
Molecule Name |
(4R,7S,10R,13S,16R,19S,22S,25S,28R,31R,34S)-34-amino-31-(4-aminobutyl)-25,28-dibenzyl-10,16-bis[(1R)-1-hydroxyethyl]-13-[(4-hydroxy-2-iodophenyl)methyl]-7-(hydroxymethyl)-22-(1H-indol-3-ylmethyl)-20-methyl-6,9,12,15,18,21,24,27,30,33-decaoxo-19-[[4-[(propan-2-ylamino)methyl]phenyl]methyl]-1,2-dithia-5,8,11,14,17,20,23,26,29,32-decazacyclopentatriacontane-4-carboxylic acid |
IUPAC Name |
(4R,7S,10R,13S,16R,19S,22S,25S,28R,31R,34S)-34-amino-31-(4-aminobutyl)-25,28-dibenzyl-10,16-bis[(1R)-1-hydroxyethyl]-13-[(4-hydroxy-2-iodophenyl)methyl]-7-(hydroxymethyl)-22-(1H-indol-3-ylmethyl)-20-methyl-6,9,12,15,18,21,24,27,30,33-decaoxo-19-[[4-[(propan-2-ylamino)methyl]phenyl]methyl]-1,2-dithia-5,8,11,14,17,20,23,26,29,32-decazacyclopentatriacontane-4-carboxylic acid |
Synonyms |
CHEBI:397882 |
InChi |
InChI=1S/C75H97IN14O16S2/c1-41(2)79-36-47-25-23-46(24-26-47)32-62-71(101)89-64(43(4)93)72(102)84-58(33-48-27-28-50(94)35-52(48)76)69(99)88-63(42(3)92)73(103)86-60(38-91)70(100)87-61(75(105)106)40-108-107-39-53(78)65(95)81-55(22-14-15-29-77)66(96)82-56(30-44-16-8-6-9-17-44)67(97)83-57(31-45-18-10-7-11-19-45)68(98)85-59(74(104)90(62)5)34-49-37-80-54-21-13-12-20-51(49)54/h6-13,16-21,23-28,35,37,41-43,53,55-64,79-80,91-94H,14-15,22,29-34,36,38-40,77-78H2,1-5H3,(H,81,95)(H,82,96)(H,83,97)(H,84,102)(H,85,98)(H,86,103)(H,87,100)(H,88,99)(H,89,101)(H,105,106)/t42-,43-,53-,55-,56-,57+,58+,59+,60+,61+,62+,63-,64-/m1/s1 |
InChiKey |
VXZIIEYCRXJBHN-XCXNQCPUSA-N |
Formula | C75H97IN14O16S2 |
Molecular Weight | 1641.69 |
Cross Link | CHEMBL407051 |
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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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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