granaticin b (CHEBI:755324)

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CHEBI:755324 - granaticin b

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ChEBI ID	CHEBI:755324
ChEBI Name	granaticin b
Stars
Last Modified	29 June 2026
Submitter	ChEMBL
Downloads	Molfile

Formula	C28H30O12
Net Charge	0
Average Mass	558.536
Monoisotopic Mass	558.17373
SMILES	[H][C@@]12OC(=O)C[C@]1([H])O[C@@H](C)C1=C2C(=O)c2c(O)c3c(c(O)c2C1=O)[C@]1(O)[C@@H](C)O[C@@H]3C[C@H]1O[C@H]1CC[C@H](O)[C@H](C)O1
InChI	InChI=1S/C28H30O12/c1-8-11(29)4-5-16(37-8)39-14-6-12-18-22(28(14,35)10(3)38-12)26(34)20-19(24(18)32)25(33)21-17(23(20)31)9(2)36-13-7-15(30)40-27(13)21/h8-14,16,27,29,32,34-35H,4-7H2,1-3H3/t8-,9-,10+,11-,12+,13-,14+,16-,27+,28-/m0/s1
InChIKey	HLNZYALGGXMQQC-VHAJSWNUSA-N

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	granaticin b (CHEBI:755324) has role antineoplastic agent (CHEBI:35610)
	granaticin b (CHEBI:755324) is a anthraquinone (CHEBI:22580)

Synonyms	Source
Granaticin b	ChEMBL
Lbs-007	ChEMBL
MM 44326	ChEMBL
MM-44326	ChEMBL
MM44326	ChEMBL
MSK-777	ChEMBL

Citations