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AG00AOPP

Name: 11-Keto-beta-boswellic acid
Brand: Angene Chemical
SKU: AG00AOPP

17019-92-0 | 11-Keto-beta-boswellic acid

Chemical structure of 11-Keto-beta-boswellic acid, CAS 17019-92-0

AG00AOPP

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CAS Number	17019-92-0
Catalog Number	AG00AOPP(AGN-PC-0Q9MVE)
Chemical Name	11-Keto-beta-boswellic acid
EC Number	605-571-5
IUPAC Name	(3R,4R,6aR,6bS,8aR,11R,12S,14bS)-3-hydroxy-4,6a,6b,8a,11,12,14b-heptamethyl-14-oxo-1,2,3,4a,5,6,7,8,9,10,11,12,12a,14a-tetradecahydropicene-4-carboxylic acid
InChI	InChI=1S/C30H46O4/c1-17-8-11-26(3)14-15-28(5)19(23(26)18(17)2)16-20(31)24-27(4)12-10-22(32)30(7,25(33)34)21(27)9-13-29(24,28)6/h16-18,21-24,32H,8-15H2,1-7H3,(H,33,34)/t17-,18+,21?,22-,23?,24?,26-,27+,28-,29-,30-/m1/s1
InChI Key	YIMHGPSYDOGBPI-IQQSWPBXSA-N
MDL Number	MFCD06656312
Molecular Formula	C30H46O4
Molecular Weight	470.6838
SMILES	C[C@@]1([C@@]2(CC[C@]3(CC[C@H]([C@@H]([C@]3(C2=C4)[H])C)C)C)C)CC[C@@]5([H])[C@](C(O)=O)(C)[C@H](O)CC[C@]5(C)[C@@]1([H])C4=O
Synonyms	11-keto-beta-boswellic acid, 11-keto-boswellic acid, 11-Keto-beta-boswellic acid, 17019-92-0, 11-Oxo-beta-boswellic acid, 3alpha-Hydroxy-11-oxours-12-en-24-oic acid, BETA-BOSWELLIC ACID,11-KETO, AC1OCF1D, 11-Keto -Boswellic Acid, 11-Ketobeta boswellic acid, 11-Keto-beta-boswellic acid;, 11-Oxo-.beta.-boswellic acid, 11-Oxo-beta-boswellic acid;, 11-Keto-.beta.-boswellic acid, SCHEMBL12786613, YIMHGPSYDOGBPI-IQQSWPBXSA-N, 7997AH, 019K920, 3.alpha.-Hydroxy-11-oxours-12-en-24-oic acid, A1-06835, (3R,4R,6aR,6bS,8aR,11R,12S,14bS)-3-hydroxy-4,6a,6b,8a,11,12,14b-heptamethyl-14-oxo-1,2,3,4a,5,6,7,8,9,10,11,12,12a,14a-tetradecahydropicene-4-carboxylic acid, Keto-b-boswellic acid, 11-keto-boswellic Acid, UNII-0S3BIF6H0Q, C30H46O4, ACN-056647, CID6918114, (3alpha,4beta)-3-Hydroxy-11-oxours-12-en-23-oic acid,

Complexity	954
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	8
Defined Bond Stereocenter Count	0
Exact Mass	470.34g/mol
Formal Charge	0
Heavy Atom Count	34
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	470.694g/mol
Monoisotopic Mass	470.34g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	74.6A^2
Undefined Atom Stereocenter Count	3
Undefined Bond Stereocenter Count	0
XLogP3	7.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H302-H315-H319-H335
Packing Group	\N
Precautionary statements	P261-P305+P351+P338
UN Code	\N

Related Research Chemicals

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Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

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Reviewed by:Jessie

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Angene International Limited