Account (1R,2S,3R,3aR,3a1R,4R,6aR,7aS,11S,11aS,11bR)-1,2,3a,4,11-pentahydroxy-3-(hydroxymethyl)-8,11a-dimethyl-1,2,3,3a,4,7,7a,11,11a,11b-decahydro-5H-3,3a1-(epoxymethano)dibenzo[de,g]chromene-5,10(6aH)-dione
- Catalog No. :
- ACHCXS738
- CAS No. :
- 95258-14-3
- Molecular Formula :
- C20H26O10
- Molecular Weight :
- 426.42
IUPAC Name:(1R,2S,3R,3aR,3a1R,4R,6aR,7aS,11S,11aS,11bR)-1,2,3a,4,11-pentahydroxy-3-(hydroxymethyl)-8,11a-dimethyl-1,2,3,3a,4,7,7a,11,11a,11b-decahydro-5H-3,3a1-(epoxymethano)dibenzo[de,g]chromene-5,10(6aH)-dione
![(1R,2S,3R,3aR,3a1R,4R,6aR,7aS,11S,11aS,11bR)-1,2,3a,4,11-pentahydroxy-3-(hydroxymethyl)-8,11a-dimethyl-1,2,3,3a,4,7,7a,11,11a,11b-decahydro-5H-3,3a1-(epoxymethano)dibenzo[de,g]chromene-5,10(6aH)-dione structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (1R,2S,3R,3aR,3a1R,4R,6aR,7aS,11S,11aS,11bR)-1,2,3a,4,11-pentahydroxy-3-(hydroxymethyl)-8,11a-dimethyl-1,2,3,3a,4,7,7a,11,11a,11b-decahydro-5H-3,3a1-(epoxymethano)dibenzo[de,g]chromene-5,10(6aH)-dione |
|---|---|
| IUPAC Name | (1R,2S,3R,3aR,3a1R,4R,6aR,7aS,11S,11aS,11bR)-1,2,3a,4,11-pentahydroxy-3-(hydroxymethyl)-8,11a-dimethyl-1,2,3,3a,4,7,7a,11,11a,11b-decahydro-5H-3,3a1-(epoxymethano)dibenzo[de,g]chromene-5,10(6aH)-dione |
| MDL No. | - |
| Molecular Formula | C20H26O10 |
| Molecular Weight | 426.42 |
| SMILES | CC1=CC(=O)[C@@H](O)[C@]2(C)[C@H]3[C@@H](O)[C@H](O)[C@@]4(CO)OC[C@@]35[C@@H](C[C@@H]12)OC(=O)[C@H](O)[C@]54O |
| InChI Key | QXKKRGMRXXMDDP-JVDXBALSSA-N |
| Synonym | (-)-13,20-Epoxy-1β,11β,12α,14,15β,21-hexahydroxypicrasa-3-ene-2,16-dione;(-)-Yadanziolide A;Yadanziolide A;Yadanziolide A(Bruceine H);Picras-3-ene-2,16-dione, 13,20-epoxy-1,11,12,14,15,21-hexahydroxy-, (1β,11β,12α,15β)-;Yadanziolide A,Inhibitor,inhibit;Yadanziolide A, 10 mM in DMSO;(1R,2S,3R,3aR,3a1R,4R,6aR,7aS,11S,11aS,11bR)-1,2,3a,4,11-Pentahydroxy-3-(hydroxymethyl)-8,11a-dimethyl-1,2,3,3a,4,7,7a,11,11a,11b-decahydro-5H-3,3a1-(epoxymethano)dibenzo[de,g]chromene-5,10(6aH)-dione |
| CAS No. | 95258-14-3 |
| PubChem CID | 10320238 |
Synthetic Route by SureRoute
2. ACHCXS738 Molecular Building Block Synthetic Route
(1R,2S,3R,3AR,3a1R,4R,6aR,7aS,11S,11aS,11bR)-1,2,3a,4,11-pentahydroxy-3,8,11a-trimethyl-1,2,3,3a,4,7,7a,11,11a,11b-decahydro-5H-3,3a1-(epoxymethano)dibenzo[de,g]chromene-5,10(6aH)-dione
(1R,2S,3R,3aR,3a1R,4R,6aR,7aS,11R,11aS,11bR)-1,2,3a,4,11-pentahydroxy-3,8,11a-trimethyl-1,2,3,3a,4,7,7a,11,11a,11b-decahydro-5H-3,3a1-(epoxymethano)dibenzo[de,g]chromene-5,10(6aH)-dione
(1R,2S,3R,3aR,3a1R,4R,6aS,7R,7aS,11S,11aS,11bR)-1,2,3a,4,7,11-hexahydroxy-3-(hydroxymethyl)-8,11a-dimethyl-1,2,3,3a,4,7,7a,11,11a,11b-decahydro-5H-3,3a1-(epoxymethano)dibenzo[de,g]chromene-5,10(6aH)-dione