(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl ]-3-sulfooxy-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a ]phenanthrene (CAS 1491-95-8) — formula C27H46O4S, molecular weight 466.7; category organic chemicals.
| CAS Number | 1491-95-8 |
|---|---|
| Molecular Formula | C27H46O4S |
| Molecular Weight | 466.7 |
| LogP | 8.2 |
| Category | Organic Chemicals |
(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl ]-3-sulfooxy-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a ]phenanthrene is a carbon-based organic compound with CAS registry number 1491-95-8 and molecular formula C27H46O4S (molecular weight 466.7), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 1491-95-8
Its molecular formula C27H46O4S comprises 27 C, 46 H, 4 O, 1 S atoms.
Also known as: (3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl ]-3-sulfooxy-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a ]phenanthrene · (3S,8S,9S,10R,13R,14S,17R)-10,13-二甲基-17-[(2R)-6-甲基庚烷-2-基]-3-磺氧基-2,3,4,7,8,9,11,12,14,15,16,17-十二氢-1H-环戊[a]菲
Category: organic chemicals
The CAS registry number of (3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl ]-3-sulfooxy-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a ]phenanthrene is 1491-95-8.
Molecular formula C27H46O4S, molecular weight 466.7.
It is also registered under: (3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl ]-3-sulfooxy-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a ]phenanthrene, (3S,8S,9S,10R,13R,14S,17R)-10,13-二甲基-17-[(2R)-6-甲基庚烷-2-基]-3-磺氧基-2,3,4,7,8,9,11,12,14,15,16,17-十二氢-1H-环戊[a]菲.
Category: Organic Chemicals.
Independent reference data for (3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl ]-3-sulfooxy-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a ]phenanthrene (CAS 1491-95-8), compiled from public chemistry databases.
| CAS 号 | 1491-95-8 |
|---|---|
| PubChem CID | 4259412 |
| 分子式 | C27H46O4S |
| IUPAC 名称 | [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate |
| Molecular Weight | 466.7 |
|---|---|
| XLogP3 | 8.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 7 |
| Exact Mass | 466.31168112 |
| Monoisotopic Mass | 466.31168112 |
| Topological Polar Surface Area | 72 |
| Heavy Atom Count | 32 |
1491-95-8; ST 27:1;O;S; SCHEMBL29586654; DTXSID70401323; CHEBI:228715
(3S,8S,9S,10R,13R,14S,17R)-10,13-二甲基-17-[(2R)-6-甲基庚烷-2-基]-3-磺氧基-2,3,4,7,8,9,11,12,14,15,16,17-十二氢-1H-环戊[a]菲 · CAS 1491-95-8 · C27H46O4S.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.