vapreotide (CHEBI:755335)

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CHEBI:755335 - vapreotide

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ChEBI ID	CHEBI:755335
ChEBI Name	vapreotide
Stars
Last Modified	29 June 2026
Submitter	ChEMBL
Downloads	Molfile

Formula	C57H70N12O9S2
Net Charge	0
Average Mass	1131.396
Monoisotopic Mass	1130.48301
SMILES	CC(C)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2cnc3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](NC(=O)[C@H](N)Cc2ccccc2)CSSC[C@@H](C(=O)N[C@@H](Cc2cnc3ccccc23)C(N)=O)NC1=O
InChI	InChI=1S/C57H70N12O9S2/c1-32(2)49-57(78)68-48(55(76)64-44(50(60)71)26-35-28-61-41-16-8-6-14-38(35)41)31-80-79-30-47(67-51(72)40(59)24-33-12-4-3-5-13-33)56(77)65-45(25-34-19-21-37(70)22-20-34)53(74)66-46(27-36-29-62-42-17-9-7-15-39(36)42)54(75)63-43(52(73)69-49)18-10-11-23-58/h3-9,12-17,19-22,28-29,32,40,43-49,61-62,70H,10-11,18,23-27,30-31,58-59H2,1-2H3,(H2,60,71)(H,63,75)(H,64,76)(H,65,77)(H,66,74)(H,67,72)(H,68,78)(H,69,73)/t40-,43+,44+,45+,46-,47+,48+,49+/m1/s1
InChIKey	SWXOGPJRIDTIRL-DOUNNPEJSA-N

Roles Classification

Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid).

ChEBI Ontology

Outgoing Relation(s)
	vapreotide (CHEBI:755335) is a polypeptide (CHEBI:15841)

INN	Source
vapreotida	WHO MedNet

Synonyms	Source
BMY-41606	ChEMBL
RC-160	ChEMBL
Vapreotide	ChEMBL

Citations