Primary Record
Trioxacarcin C
- In stock
- 9,406 g
- Purity
- 99.0 %
- CAS
- 81781-28-4
Compound Identifiers & Properties
- CAS
- 81781-28-4
- PubChem CID
- 131885538
- 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@]68CO8)(O7)C(OC)OC)O[C@H]9C[C@H]([C@]([C@@H](O9)C)(C(C)O)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@@]31CO1)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 C
- J2.133.485E
- (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-dihydroxy-13-[4-C-(1-hydroxyethyl)-2,6-dideoxy-alpha-L-idopyranosyloxy]spiro[2,13-methano-3a,7,8,9,10,13,13a-heptahydro-2H-1,3,12-trioxa-1H-indeno[5,4-a]anthracene-14,2 -oxirane]-10-one
- (2S,3R,4R,6R)-6-[(1S,8S,10S,17S,18S,19R,21S)-17-{[(2S,4R,5S,6S)-4,5-dihydroxy-5-(1-hydroxyethyl)-6-methyloxan-2-yl]oxy}-19-(dimethoxymethyl)-10,13-dihydroxy-6-methoxy-3-methyl-16,20,22-trioxaspiro[hexacyclo[17.2.1.02,15.05,14.07,12.017,21]docosane-18,2'-oxirane]-2,4,6,12,14-pentaen-11-oneoxy]-4-hydroxy-2,4-dimethyloxan-3-yl acetate
- 81781-28-4