Cas no 15399-34-5 (2-Chryseneaceticacid, octadecahydro-2,4a,6a,7,10b,12a-hexamethyl-, (2R,4aR,4bS,6aR,7S,10aR,10bS,12aS)-)
15399-34-5 structure
Product Name:2-Chryseneaceticacid, octadecahydro-2,4a,6a,7,10b,12a-hexamethyl-, (2R,4aR,4bS,6aR,7S,10aR,10bS,12aS)-
CAS No:15399-34-5
MF:C26H44O2
MW:388.626368522644
CID:235764
PubChem ID:71356027
Update Time:2025-04-19
2-Chryseneaceticacid, octadecahydro-2,4a,6a,7,10b,12a-hexamethyl-, (2R,4aR,4bS,6aR,7S,10aR,10bS,12aS)- Chemical and Physical Properties
Names and Identifiers
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- 2-Chryseneaceticacid, octadecahydro-2,4a,6a,7,10b,12a-hexamethyl-, (2R,4aR,4bS,6aR,7S,10aR,10bS,12aS)-
- 2-[(2R,4aR,4bS,6aR,7S,10aR,10bS,12aS)-2,4a,6a,7,10b,12a-hexamethyl-3,4,4b,5,6,7,8,9,10,10a,11,12-dodecahydro-1H-chrysen-2-yl]acetic acid
- 2-Chryseneacetic acid, octadecahydro-2,4a,6a,7,10b,12a-hexamethyl-, [2R-(2a,4ab,4ba,6ab,7b,10aa,10bb,12aa)]-
- D-Homo-5a-androstane-3a-acetic acid,3,5,8,17ab-tetramethyl- (8CI)
- D-Homoandrostane-3-acetic acid,3,5,8,17a-tetramethyl-,(3a,5a,17ab)-
- Tetranorshionan-23-oic acid
- Tetranorshionanoicacid
- [(2R,4aR,4bS,6aR,7S,10aR,10bS,12aS)-2,4a,6a,7,10b,12a-Hexamethyloctadecahydrochrysen-2-yl]acetic acid
- 15399-34-5
- DTXSID20780190
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- Inchi： 1S/C26H44O2/c1-18-8-7-9-19-24(18,4)11-10-20-25(19,5)14-13-23(3)17-22(2,16-21(27)28)12-15-26(20,23)6/h18-20H,7-17H2,1-6H3,(H,27,28)/t18-,19+,20-,22-,23-,24+,25-,26+/m0/s1
- InChI Key： RJXXUDMVMLKXNN-XJEILDJMSA-N
- SMILES： OC(C[C@]1(C)CC[C@@]2(C)[C@](C)(C1)CC[C@@]1(C)[C@@H]3CCC[C@H](C)[C@@]3(C)CC[C@@H]12)=O
Computed Properties
- Exact Mass: 388.334130642g/mol
- Monoisotopic Mass: 388.334130642g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 28
- Rotatable Bond Count: 2
- Complexity: 657
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 8
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 8.8
- Topological Polar Surface Area: 37.3?2
2-Chryseneaceticacid, octadecahydro-2,4a,6a,7,10b,12a-hexamethyl-, (2R,4aR,4bS,6aR,7S,10aR,10bS,12aS)- Related Literature
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Jason Wan Lab Chip, 2020,20, 4528-4538
15399-34-5 (2-Chryseneaceticacid, octadecahydro-2,4a,6a,7,10b,12a-hexamethyl-, (2R,4aR,4bS,6aR,7S,10aR,10bS,12aS)-) Related Products
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