Primary Record
Trioxacarcin B
- In stock
- 550 g
- Purity
- 98.1 %
Compound Identifiers & Properties
- PubChem CID
- 177403554
- SMILES
- C[C@H]1[C@H]([C@](C[C@@H](O1)O[C@H]2C[C@@H](C(=O)C3=C(C4=C(C=C(C5=C4O[C@@]6([C@@H]7[C@H]5O[C@]([C@@]6(CO)O)(O7)C(OC)OC)O[C@H]8C[C@H]([C@]([C@@H](O8)C)(C(=O)C)O)O)C)C(=C23)OC)O)O)(C)O)OC(=O)C
- Canonical SMILES
- COc1c2c(c(O)c3c4c(c(C)cc13)[C@@H]1O[C@@]3(C(OC)OC)O[C@@H]1[C@@](O[C@H]1C[C@@H](O)[C@@](O)(C(C)=O)[C@H](C)O1)(O4)[C@@]3(O)CO)C(=O)[C@@H](O)C[C@@H]2O[C@H]1C[C@@](C)(O)[C@H](OC(C)=O)[C@H](C)O1
Names & Synonyms
- Trioxacarcin B
- J2.027.327E
- (2R,3aS,7S,9S,13S,13aS,14S)-2-(Dimethoxymethyl)-4-methyl-6-methoxy-7-(3-C-methyl-4-O-acetyl-2,6-dideoxy-alpha-L-idopyranosyloxy)-9,11,14-trihydroxy-13-(4-C-acetyl-2,6-dideoxy-alpha-L-idopyranosyloxy)-14-(hydroxymethyl)-2,13-methano-3a,7,8,9,10,13,13a-heptahydro-2H-1,3,12-trioxa-1H-indeno[5,4-a]anthracene-10-one
- (2S,3R,4R,6R)-6-{[(1S,8S,10S,17S,18S,19R,21S)-17-{[(2S,4R,5S,6S)-5-acetyl-4,5-dihydroxy-6-methyloxan-2-yl]oxy}-19-(dimethoxymethyl)-10,13,18-trihydroxy-18-(hydroxymethyl)-6-methoxy-3-methyl-11-oxo-16,20,22-trioxahexacyclo[17.2.1.02,15.05,14.07,12.017,21]docosa-2,4,6,12,14-pentaen-8-yl]oxy}-4-hydroxy-2,4-dimethyloxan-3-yl acetate