1-[(4S,7S,8R)-5-[2-(dimethylamino)-1-oxoethyl]-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-propan-2-ylurea (CHEBI:112119)

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CHEBI:112119 - 1-[(4S,7S,8R)-5-[2-(dimethylamino)-1-oxoethyl]-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-propan-2-ylurea

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ChEBI ID	CHEBI:112119
ChEBI Name	1-[(4S,7S,8R)-5-[2-(dimethylamino)-1-oxoethyl]-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-propan-2-ylurea
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Downloads	Molfile

Formula	C25H41N5O5
Net Charge	0
Average Mass	491.633
Monoisotopic Mass	491.31077
SMILES	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(C(=O)CN(C)C)C[C@@H]1C
InChI	InChI=1S/C25H41N5O5/c1-16(2)26-25(33)27-19-9-10-21-20(11-19)24(32)29(7)13-22(34-8)17(3)12-30(18(4)15-35-21)23(31)14-28(5)6/h9-11,16-18,22H,12-15H2,1-8H3,(H2,26,27,33)/t17-,18-,22-/m0/s1
InChIKey	AWYPCRXSVTZAPT-SPEDKVCISA-N

ChEBI Ontology

Outgoing Relation(s)
	1-[(4S,7S,8R)-5-[2-(dimethylamino)-1-oxoethyl]-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-propan-2-ylurea (CHEBI:112119) is a azamacrocycle (CHEBI:52898)
	1-[(4S,7S,8R)-5-[2-(dimethylamino)-1-oxoethyl]-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-propan-2-ylurea (CHEBI:112119) is a lactam (CHEBI:24995)

Manual Xrefs	Databases
LSM-23531	LINCS