Account (R)-4-((3R,5R,6S,8S,9S,10R,13R,14S,17R)-3,6-dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)-N-(6-(3-(3',6'-dihydroxy-3-oxo-3H-spiro[isobenzofuran-1,9'-xanthen]-5-yl)thioureido)hexyl)pentanamide
- Catalog No. :
- ACPLFM722
- CAS No. :
- 2374144-21-3
- Molecular Formula :
- C51H65N3O8S
- Molecular Weight :
- 880.16
IUPAC Name:(R)-4-((3R,5R,6S,8S,9S,10R,13R,14S,17R)-3,6-dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)-N-(6-(3-(3',6'-dihydroxy-3-oxo-3H-spiro[isobenzofuran-1,9'-xanthen]-5-yl)thioureido)hexyl)pentanamide
![(R)-4-((3R,5R,6S,8S,9S,10R,13R,14S,17R)-3,6-dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)-N-(6-(3-(3',6'-dihydroxy-3-oxo-3H-spiro[isobenzofuran-1,9'-xanthen]-5-yl)thioureido)hexyl)pentanamide structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (R)-4-((3R,5R,6S,8S,9S,10R,13R,14S,17R)-3,6-dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)-N-(6-(3-(3',6'-dihydroxy-3-oxo-3H-spiro[isobenzofuran-1,9'-xanthen]-5-yl)thioureido)hexyl)pentanamide |
|---|---|
| IUPAC Name | (R)-4-((3R,5R,6S,8S,9S,10R,13R,14S,17R)-3,6-dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)-N-(6-(3-(3',6'-dihydroxy-3-oxo-3H-spiro[isobenzofuran-1,9'-xanthen]-5-yl)thioureido)hexyl)pentanamide |
| Molecular Formula | C51H65N3O8S |
| Molecular Weight | 880.16 |
| SMILES | C[C@H](CCC(=O)NCCCCCCNC(=S)NC1=CC2=C(C=C1)C1(OC2=O)C2=CC=C(O)C=C2OC2=C1C=CC(O)=C2)[C@H]1CC[C@H]2[C@@H]3C[C@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |
| InChI Key | MFJKSCWIKMCTMG-RGOSNDNESA-N |
| Synonym | (3α,5β,6α)-N-[6-[[[(3′,6′-Dihydroxy-3-oxospiro[isobenzofuran-1(3H),9′-[9H]xanthen]-5-yl)amino]thioxomethyl]amino]hexyl]-3,6-dihydroxycholan-24-amide;FITC-Hyodeoxycholic acid |
| CAS No. | 2374144-21-3 |
Synthetic Route by SureRoute
2. ACPLFM722 Molecular Building Block Synthetic Route
8-(3-(3',6'-DIhydroxy-3-oxo-3h-spiro[isobenzofuran-1,9'-xanthen]-5-yl)thioureido)octanoic acid
1-(6-Aminohexyl)-3-(3',6'-dihydroxy-3-oxo-3H-spiro[isobenzofuran-1,9'-xanthen]-5-yl)thiourea hydrochloride
1-(6-Aminohexyl)-3-(3',6'-dihydroxy-3-oxo-3H-spiro[isobenzofuran-1,9'-xanthen]-5-yl)thiourea