Basic information
- CAS
83329-66-2- Standard SMILES
CC[C@H]1CC[C@@]2(C)[C@@H]1CC[C@]1(C)[C@@H]2CC[C@@H]2[C@H]3CCCC(C)(C)[C@@H]3CC[C@]21C- InChIKey
YOWUJGOPPFZUDE-RCTMHZSHSA-N- Molecular formula
- C28H48
- Average molar mass
- 384.7 g/mol
Names & identifiers
- Preferred name
- 17alpha(H), 21beta(H)-25,30-BISNORHOPANE
- IUPAC
- (3S,3aR,5aR,5bR,7aR,11aS,11bR,13aR,13bS)-3-ethyl-5a,5b,8,8,13b-pentamethyl-2,3,3a,4,5,6,7,7a,9,10,11,11a,11b,12,13,13a-hexadecahydro-1H-cyclopenta[a]chrysene
- English name
- 17ALPHA(H), 21BETA(H)-25,30-BISNORHOPANE
- Molecular formula
- C28H48
- Molecular weight
- 384.687
Names & synonyms
83329-66-217alpha(H), 21beta(H)-25,30-BISNORHOPANE(3S,3aR,5aR,5bR,7aR,11aS,11bR,13aR,13bS)-3-ethyl-5a,5b,8,8,13b-pentamethyl-2,3,3a,4,5,6,7,7a,9,10,11,11a,11b,12,13,13a-hexadecahydro-1H-cyclopenta[a]chrysene17a(H),21B(H)-25,30-Bisnorhopane28ABETA17α(H),21(H)-25,30-Bisnorhopane
Database identifiers
- CAS
83329-66-2- Nikkaji
- J2.869.245E
Properties
Computed structural properties
- XLogP
- 10.8
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 618
Chemistry & industry
Suppliers2 total
CHIRON[email protected]
上海甄准生物科技有限公司15800340161 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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