bms-986310 (CHEBI:759603)

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CHEBI:759603 - bms-986310

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ChEBI ID	CHEBI:759603
ChEBI Name	bms-986310
Stars
Last Modified	30 June 2026
Submitter	ChEMBL
Downloads	Molfile

Formula	C27H29N3O5
Net Charge	0
Average Mass	475.545
Monoisotopic Mass	475.21072
SMILES	CC(C)NC(=O)c1ccc2c(c1)[C@]1(CCO2)C[C@H]1C(=O)Nc1cc(C#N)ccc1CCCC(=O)O
InChI	InChI=1S/C27H29N3O5/c1-16(2)29-25(33)19-8-9-23-20(13-19)27(10-11-35-23)14-21(27)26(34)30-22-12-17(15-28)6-7-18(22)4-3-5-24(31)32/h6-9,12-13,16,21H,3-5,10-11,14H2,1-2H3,(H,29,33)(H,30,34)(H,31,32)/t21-,27-/m0/s1
InChIKey	QSRLBYGDVFRMPT-IDISGSTGSA-N

Roles Classification

antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms.

ChEBI Ontology

Outgoing Relation(s)
	bms-986310 (CHEBI:759603) has role antineoplastic agent (CHEBI:35610)
	bms-986310 (CHEBI:759603) is a 1-benzopyran (CHEBI:38443)

Synonyms	Source
Bms-986310	ChEMBL
Ono-4578	ChEMBL