Benzoylmesaconine hydrochloride

Catalog Number	ACM126266384
CAS Number	126266-38-4
Structure
Synonyms	(1a,3a,6a,14a,15a,16b)-1,6,8,16-Tetramethoxy-4-(methoxymethyl)-20-methylaconitane-3,13,14,15-tetrol 14-benzoate hydrochloride
Molecular Weight	644.1
Molecular Formula	C32H45NO10.HCl
InChI	InChI=1S/C31H43NO10.ClH.H₂O/c1-32-14-27(15-38-2)18(33)11-19(39-3)30-17-12-28(35)20(40-4)13-29(36,21(24(30)32)22(41-5)23(27)30)31(17,37)26(28)42-25(34)16-9-7-6-8-10-16;/h6-10,17-24,26,33,35-37H,11-15H2,1-5H3;1H;1H2/t17-,18+,19-,20-,21-,22-,23+,24,26-,27-,28-,29-,30-,31+;/m0/s1
InChI Key	XRTSTRVVIFSUJU-AXODCOLYSA-N
Purity	95%+
Complexity	1100
Covalently-Bonded Unit Count	3
Defined Atom Stereocenter Count	13
Exact Mass	643.275939
Heavy Atom Count	44
Hydrogen Bond Acceptor Count	12
Hydrogen Bond Donor Count	6
Isomeric SMILES	CN1C[C@@]2([C@@H](C[C@@H]([C@@]34[C@@H]2[C@H]([C@@H](C31)[C@]5(C[C@@H]([C@]6(C[C@@H]4[C@]5([C@H]6OC(=O)C7=CC=CC=C7)O)O)OC)O)OC)OC)O)COC.O.Cl
Monoisotopic Mass	643.275939
PhysicalState	Powder
Rotatable Bond Count	8
Topological Polar Surface Area	148 Ų

Custom Q&A

What is the chemical name for the compound known as Benzoylmesaconine hydrochloride?

The chemical name for the compound is (1a,3a,6a,14a,15a,16b)-1,6,8,16-Tetramethoxy-4-(methoxymethyl)-20-methylaconitane-3,13,14,15-tetrol 14-benzoate hydrochloride.

What are the synonyms for Benzoylmesaconine hydrochloride?

The synonyms include BENZOYLMESACONINE HYDROCHLORIDE, Hokbusine A hydrochloride, and Benzoylmesaconine hydrochloride/Hokbusine A hydrochloride.

What is the CAS number for Benzoylmesaconine hydrochloride?

The CAS number is 126266-38-4.

What is the molecular formula of Benzoylmesaconine hydrochloride?

The molecular formula is C31H46ClNO11.

What is the molecular weight of Benzoylmesaconine hydrochloride?

The molecular weight is 644.15.

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