Account (1R,3S,Z)-5-(2-((1R,3aS,7aR,E)-1-((2R,5R,E)-5-Cyclopropyl-5-hydroxypent-3-en-2-yl)-7a-methyloctahydro-4H-inden-4-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diol
- Catalog No. :
- ACZHUJ018
- CAS No. :
- 112827-99-3
- Molecular Formula :
- C27H40O3
- Molecular Weight :
- 412.61
IUPAC Name:(1R,3S,Z)-5-(2-((1R,3aS,7aR,E)-1-((2R,5R,E)-5-cyclopropyl-5-hydroxypent-3-en-2-yl)-7a-methyloctahydro-4H-inden-4-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diol
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Product Information
| Product Name | (1R,3S,Z)-5-(2-((1R,3aS,7aR,E)-1-((2R,5R,E)-5-Cyclopropyl-5-hydroxypent-3-en-2-yl)-7a-methyloctahydro-4H-inden-4-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diol |
|---|---|
| IUPAC Name | (1R,3S,Z)-5-(2-((1R,3aS,7aR,E)-1-((2R,5R,E)-5-cyclopropyl-5-hydroxypent-3-en-2-yl)-7a-methyloctahydro-4H-inden-4-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diol |
| MDL No. | MFCD25541648 |
| Molecular Formula | C27H40O3 |
| Molecular Weight | 412.61 |
| SMILES | O[C@H]1C[C@H](O)C(/C(C1)=C\C=C2[C@]3([H])CC[C@H]([C@H](C)/C=C/[C@@H](C4CC4)O)[C@@]3(C)CCC\2)=C |
| InChI Key | LWQQLNNNIPYSNX-CIJZWTHJSA-N |
| Synonym | CALCIPOTRIOL IMPURITY D [EP IMPURITY] | Calcipotriol, 24R- | TYF37XV46I | Q27290482 | PRI-2202 | 9,10-Secochola-5,7,10(19),22-tetraene-1,3,24-triol, 24-cyclopropyl-, (1alpha,3beta,5Z,7E,22E,24R)- | (5Z,7E,22E,24R)-24-CYCLOPROPYL-9,10-SECOCHOLA-5,7,10(19), |
| CAS No. | 112827-99-3 |
| PubChem CID | 9547353 |
Safety Data
- Pictogram
- Signal Word
- Danger
- Hazard Statement(s)
- H300-H311-H331-H373
- Precautionary Statement(s)
- P261-P264-P280-P301+P310-P311
Synthetic Route by SureRoute
2. ACZHUJ018 Molecular Building Block Synthetic Route
(1R,3S,Z)-5-((E)-2-((1R,3aS,7aR)-1-((2R,5S,E)-5-cyclopropyl-5-hydroxypent-3-en-2-yl)-7a-methylhexahydro-1H-inden-4(2H)-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diol
(1R,3S,Z)-5-(2-((1R,3aS,7aR,E)-1-((2R,5S,E)-5-Cyclopropyl-5-hydroxypent-3-en-2-yl)-7a-methyloctahydro-4H-inden-4-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diol hydrate
(1S,3S,E)-5-(2-((1R,3aS,7aR,E)-1-((2R,5S,E)-5-Cyclopropyl-5-hydroxypent-3-en-2-yl)-7a-methyloctahydro-4H-inden-4-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diol