Cas no 35306-34-4 ((7alpha,8beta,9alpha)-dendroban-12-one hydrochloride (1:1))
35306-34-4 structure
Product Name:(7alpha,8beta,9alpha)-dendroban-12-one hydrochloride (1:1)
CAS No:35306-34-4
MF:C16H26ClNO2
MW:299.83614397049
CID:1469469
PubChem ID:215246
Update Time:2024-03-02
(7alpha,8beta,9alpha)-dendroban-12-one hydrochloride (1:1) Chemical and Physical Properties
Names and Identifiers
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- (7alpha,8beta,9alpha)-dendroban-12-one hydrochloride (1:1)
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- Inchi: 1S/C16H25NO2.ClH/c1-8(2)11-12-10-6-5-9-7-17(4)14(16(9,10)3)13(11)19-15(12)18;/h8-14H,5-7H2,1-4H3;1H/t9-,10+,11+,12+,13+,14-,16+;/m1./s1
- InChI Key: KOTZYABOMHJSEA-RXRHBCKHSA-N
- SMILES: Cl.O1C([C@@H]2[C@H](C(C)C)[C@H]1[C@@H]1[C@@]3(C)[C@@H](CN1C)CC[C@H]32)=O
Computed Properties
- Exact Mass: 299.1652068g/mol
- Monoisotopic Mass: 299.1652068g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 20
- Rotatable Bond Count: 1
- Complexity: 435
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 7
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 29.5?2
(7alpha,8beta,9alpha)-dendroban-12-one hydrochloride (1:1) Related Literature
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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