sjg-136 (CHEBI:747990)

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CHEBI:747990 - sjg-136

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ChEBI ID	CHEBI:747990
ChEBI Name	sjg-136
Stars
Last Modified	29 June 2026
Submitter	ChEMBL
Downloads	Molfile

Formula	C31H32N4O6
Net Charge	0
Average Mass	556.619
Monoisotopic Mass	556.23218
SMILES	[H][C@]12C=Nc3cc(OCCCOc4cc5c(cc4OC)C(=O)N4CC(=C)C[C@@]4([H])C=N5)c(OC)cc3C(=O)N1CC(=C)C2
InChI	InChI=1S/C31H32N4O6/c1-18-8-20-14-32-24-12-28(26(38-3)10-22(24)30(36)34(20)16-18)40-6-5-7-41-29-13-25-23(11-27(29)39-4)31(37)35-17-19(2)9-21(35)15-33-25/h10-15,20-21H,1-2,5-9,16-17H2,3-4H3/t20-,21-/m0/s1
InChIKey	RWZVMMQNDHPRQD-SFTDATJTSA-N

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	sjg-136 (CHEBI:747990) has role antineoplastic agent (CHEBI:35610)
	sjg-136 (CHEBI:747990) is a pyrrolobenzodiazepine (CHEBI:131437)

Synonyms	Source
BN-2629	ChEMBL
NSC-694501	ChEMBL
SG-2000	ChEMBL
Sjg 136	ChEMBL
Sjg-136	ChEMBL
SP-2001	ChEMBL

Citations