About: benzylcarbonyl-DL-Abu-DL-xiThr(1)-DL-Phe-DL-Pro-DL-Val-DL-Val-DL-Val-(1)

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About: benzylcarbonyl-DL-Abu-DL-xiThr(1)-DL-Phe-DL-Pro-DL-Val-DL-Val-DL-Val-(1) Goto Sponge Distinct Permalink

An Entity of Type : wikibase:Item, within Data Space : wikidata.demo.openlinksw.com associated with source document(s)

group of stereoisomers with the chemical formula C₄₅H₆₃N₇O₉

Attributes	Values
rdf:type	Item
description	groep van stereo-isomeren (nl) group of stereoisomers with the chemical formula C₄₅H₆₃N₇O₉ (en) група стереоізомерів з хімічною формулою C₄₅H₆₃N₇O₉ (uk)
rdfs:label	benzylcarbonyl-DL-Abu-DL-xiThr(1)-DL-Phe-DL-Pro-DL-Val-DL-Val-DL-Val-(1) (en)
skos:prefLabel	benzylcarbonyl-DL-Abu-DL-xiThr(1)-DL-Phe-DL-Pro-DL-Val-DL-Val-DL-Val-(1) (en)
name	benzylcarbonyl-DL-Abu-DL-xiThr(1)-DL-Phe-DL-Pro-DL-Val-DL-Val-DL-Val-(1) (en)
instance of	wds:Q104169310-0ECA92E1-4ECE-4663-BADB-7C91C1CF4E8B
instance of	group of stereoisomers
subclass of	wds:Q104169310-03D6F87F-473B-489F-B7FB-67947882F0F1
subclass of	biogenic cyclopeptide
canonical SMILES	wds:Q104169310-7C6679EC-EDB3-4F84-85E4-7D2687B4D0AD
InChI	wds:Q104169310-497F3035-8BED-4DDB-BF9A-BEAEAB869D66
InChIKey	wds:Q104169310-14E6E935-8AC7-4D65-ADF6-FA13F0CF742D
chemical formula	wds:Q104169310-E1DD5958-F094-43DB-BAB1-6A51E622D212
PubChem CID	wds:Q104169310-93CAB7C6-56E5-44C4-AB64-2DBD2037E06D
PubChem CID	http://rdf.ncbi.nlm.nih.gov/pubchem/compound/CID78136536
canonical SMILES	CCC(NC(=O)Cc1ccccc1)C(=O)NC1C(=O)NC(Cc2ccccc2)C(=O)N2CCCC2C(=O)NC(C(C)C)C(=O)NC(C(C)C)C(=O)NC(C(C)C)C(=O)OC1C
InChI	InChI=1S/C45H63N7O9/c1-9-31(46-34(53)24-30-19-14-11-15-20-30)39(54)51-38-28(8)61-45(60)37(27(6)7)50-42(57)36(26(4)5)49-41(56)35(25(2)3)48-40(55)33-21-16-22-52(33)44(59)32(47-43(38)58)23-29-17-12-10-13-18-29/h10-15,17-20,25-28,31-33,35-38H,9,16,21-24H2,1-8H3,(H,46,53)(H,47,58)(H,48,55)(H,49,56)(H,50,57)(H,51,54)
InChIKey	JACMSICGJTWEIY-UHFFFAOYSA-N
chemical formula	C₄₅H₆₃N₇O₉
PubChem CID	78136536
mass	wds:Q104169310-341830FF-8C39-4F48-A03B-3DDEB3AD5B63
mass	846.0249 (xsd:decimal)
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q104169310
is subclass of of	Xentrivalpeptide H
is subclass of of	wds:Q105123674-FB712C50-2DEC-4D3A-8DA9-68F1A744D4AD

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